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

Systemtic Name: N-(2-aminophenyl)-6-[2-oxidanylidene-2-[(phenylmethyl)amino]-1-(2-pyridin-2-ylethylamino)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-oxo-1-[2-(2-pyridyl)ethylamino]ethyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[2-oxo-2-[(phenylmethyl)amino]-1-[2-(2-pyridinyl)ethylamino]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-oxo-1-(2-pyridin-2-ylethylamino)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-keto-1-[2-(2-pyridyl)ethylamino]ethyl]benzothiophene-2-carboxamide Formula: C31H29N5O2S MolecularWeight: 535.65926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)NCCC5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)NCCC5=CC=CC=N5

InChI

InChI=1S/C31H29N5O2S/c32-25-11-4-5-12-26(25)36-30(37)28-18-22-13-14-23(19-27(22)39-28)29(34-17-15-24-10-6-7-16-33-24)31(38)35-20-21-8-2-1-3-9-21/h1-14,16,18-19,29,34H,15,17,20,32H2,(H,35,38)(H,36,37)