N-(2-aminophenyl)-6-[1-[3-(dimethylamino)propylamino]-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[1-[3-(dimethylamino)propylamino]-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[2-(benzylamino)-1-[3-(dimethylamino)propylamino]-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[1-[3-(dimethylamino)propylamino]-2-oxo-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[2-(benzylamino)-1-[3-(dimethylamino)propylamino]-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[2-(benzylamino)-1-[3-(dimethylamino)propylamino]-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C29H33N5O2S MolecularWeight: 515.66962

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(C1=CC2=C(C=C1)C=C(S2)C(=O)NC3=CC=CC=C3N)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CN(C)CCCNC(C1=CC2=C(C=C1)C=C(S2)C(=O)NC3=CC=CC=C3N)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C29H33N5O2S/c1-34(2)16-8-15-31-27(29(36)32-19-20-9-4-3-5-10-20)22-14-13-21-17-26(37-25(21)18-22)28(35)33-24-12-7-6-11-23(24)30/h3-7,9-14,17-18,27,31H,8,15-16,19,30H2,1-2H3,(H,32,36)(H,33,35)