N-(2-aminophenyl)-6-[2-oxidanylidene-1-(phenethylamino)-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[2-oxidanylidene-1-(phenethylamino)-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-oxo-1-(phenethylamino)ethyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[2-oxo-1-(phenethylamino)-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-oxo-1-(phenethylamino)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-keto-1-(phenethylamino)ethyl]benzothiophene-2-carboxamide Formula: C32H30N4O2S MolecularWeight: 534.6712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCNC(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C32H30N4O2S/c33-26-13-7-8-14-27(26)36-31(37)29-19-24-15-16-25(20-28(24)39-29)30(34-18-17-22-9-3-1-4-10-22)32(38)35-21-23-11-5-2-6-12-23/h1-16,19-20,30,34H,17-18,21,33H2,(H,35,38)(H,36,37)