4-azanyl-N5-[1-(1H-indol-3-yl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N5-phenyl-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[1-(1H-indol-3-yl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N5-phenyl-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(benzylamino)-1-(1H-indol-3-yl)-2-oxo-ethyl]-N5-phenyl-isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[1-(1H-indol-3-yl)-2-oxo-2-[(phenylmethyl)amino]ethyl]-N5-phenylisothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(benzylamino)-1-(1H-indol-3-yl)-2-oxoethyl]-5-N-phenyl-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(benzylamino)-1-(1H-indol-3-yl)-2-keto-ethyl]-N'-phenyl-isothiazole-3,5-dicarboxamide Formula: C28H24N6O3S MolecularWeight: 524.59356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(C2=CNC3=CC=CC=C32)N(C4=CC=CC=C4)C(=O)C5=C(C(=NS5)C(=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(C2=CNC3=CC=CC=C32)N(C4=CC=CC=C4)C(=O)C5=C(C(=NS5)C(=O)N)N

InChI

InChI=1S/C28H24N6O3S/c29-22-23(26(30)35)33-38-25(22)28(37)34(18-11-5-2-6-12-18)24(20-16-31-21-14-8-7-13-19(20)21)27(36)32-15-17-9-3-1-4-10-17/h1-14,16,24,31H,15,29H2,(H2,30,35)(H,32,36)