2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide

C7H15N3O2S2 — CID 4200065

IUPAC2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide
SMILESCCSC1=NCCN1S(=O)(=O)N(C)C
InChIInChI=1S/C7H15N3O2S2/c1-4-13-7-8-5-6-10(7)14(11,12)9(2)3/h4-6H2,1-3H3
InChIKeySNAYZQHDVPFLRI-UHFFFAOYSA-N
MW237.35 g/mol
LogP0.22
Rot. Bonds3

About 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide

2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide (PubChem CID 4200065) has the molecular formula C7H15N3O2S2 and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide.

Molecular Properties

Compound Name2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide
PubChem CID4200065
Molecular FormulaC7H15N3O2S2
Molecular Weight237.35 g/mol
Exact Mass237.06
IUPAC Name2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide
SMILESCCSC1=NCCN1S(=O)(=O)N(C)C
InChIInChI=1S/C7H15N3O2S2/c1-4-13-7-8-5-6-10(7)14(11,12)9(2)3/h4-6H2,1-3H3
InChIKeySNAYZQHDVPFLRI-UHFFFAOYSA-N
XLogP0.22
TPSA52.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide?
The IUPAC name of 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide (CID 4200065) is 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide.
What is the SMILES notation for 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide?
The canonical SMILES for 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide is CCSC1=NCCN1S(=O)(=O)N(C)C.
What is the InChIKey of 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide?
The InChIKey is SNAYZQHDVPFLRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2S2/c1-4-13-7-8-5-6-10(7)14(11,12)9(2)3/h4-6H2,1-3H3.
What are the key properties of 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide?
2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide has a molecular weight of 237.35 g/mol, XLogP of 0.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylsulfanyl-N,N-dimethyl-4,5-dihydroimidazole-1-sulfonamide is sourced from PubChem (CID 4200065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).