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

Systemtic Name: N-[2-(2-azanyl-4-methyl-phenyl)sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-(2-amino-4-methyl-phenyl)sulfanylacetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[(2-amino-4-methylphenyl)thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-(2-amino-4-methylphenyl)sulfanylacetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[(2-amino-4-methyl-phenyl)thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C15H17N3O2S MolecularWeight: 303.37938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)NC(=O)C2=CC=CN2C)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)NC(=O)C2=CC=CN2C)N

InChI

InChI=1S/C15H17N3O2S/c1-10-5-6-13(11(16)8-10)21-9-14(19)17-15(20)12-4-3-7-18(12)2/h3-8H,9,16H2,1-2H3,(H,17,19,20)