4-methyl-N-(2-pyrrol-1-ylethyl)benzenecarbothioamide

Systemtic Name: 4-methyl-N-(2-pyrrol-1-ylethyl)benzenecarbothioamide Openeye Name: 4-methyl-N-(2-pyrrol-1-ylethyl)benzenecarbothioamide CAS Name: 4-methyl-N-[2-(1-pyrrolyl)ethyl]benzenecarbothioamide IUPAC Name: 4-methyl-N-(2-pyrrol-1-ylethyl)benzenecarbothioamide Traditional Name: 4-methyl-N-(2-pyrrol-1-ylethyl)thiobenzamide Formula: C14H16N2S MolecularWeight: 244.35524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)NCCN2C=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)NCCN2C=CC=C2

InChI

InChI=1S/C14H16N2S/c1-12-4-6-13(7-5-12)14(17)15-8-11-16-9-2-3-10-16/h2-7,9-10H,8,11H2,1H3,(H,15,17)