N-(2-aminophenyl)-6-[[(4-methylphenyl)carbonylamino]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[[(4-methylphenyl)carbonylamino]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[[(4-methylbenzoyl)amino]methyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[[[(4-methylphenyl)-oxomethyl]amino]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[[(4-methylbenzoyl)amino]methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[(p-toluoylamino)methyl]benzothiophene-2-carboxamide Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C24H21N3O2S/c1-15-6-9-17(10-7-15)23(28)26-14-16-8-11-18-13-22(30-21(18)12-16)24(29)27-20-5-3-2-4-19(20)25/h2-13H,14,25H2,1H3,(H,26,28)(H,27,29)