N-[2-(4-azanyl-2-methyl-phenyl)sulfanylethanoyl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-(4-azanyl-2-methyl-phenyl)sulfanylethanoyl]-1H-pyrrole-2-carboxamide Openeye Name: N-[2-(4-amino-2-methyl-phenyl)sulfanylacetyl]-1H-pyrrole-2-carboxamide CAS Name: N-[2-[(4-amino-2-methylphenyl)thio]-1-oxoethyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[2-(4-amino-2-methylphenyl)sulfanylacetyl]-1H-pyrrole-2-carboxamide Traditional Name: N-[2-[(4-amino-2-methyl-phenyl)thio]acetyl]-1H-pyrrole-2-carboxamide Formula: C14H15N3O2S MolecularWeight: 289.3528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCC(=O)NC(=O)C2=CC=CN2

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCC(=O)NC(=O)C2=CC=CN2

InChI

InChI=1S/C14H15N3O2S/c1-9-7-10(15)4-5-12(9)20-8-13(18)17-14(19)11-3-2-6-16-11/h2-7,16H,8,15H2,1H3,(H,17,18,19)