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

Systemtic Name: N-(2-aminophenyl)-6-[2-oxidanylidene-2-[(phenylmethyl)amino]-1-pyrrolidin-1-yl-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-oxo-1-pyrrolidin-1-yl-ethyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[2-oxo-2-[(phenylmethyl)amino]-1-(1-pyrrolidinyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-oxo-1-pyrrolidin-1-ylethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[2-(benzylamino)-2-keto-1-pyrrolidino-ethyl]benzothiophene-2-carboxamide Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=CC=CC=C4N)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O2S/c29-22-10-4-5-11-23(22)31-27(33)25-16-20-12-13-21(17-24(20)35-25)26(32-14-6-7-15-32)28(34)30-18-19-8-2-1-3-9-19/h1-5,8-13,16-17,26H,6-7,14-15,18,29H2,(H,30,34)(H,31,33)