3-[3-[3-(1H-indol-3-yl)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]-2-(3-methylphenyl)imino-1,3-thiazol-4-yl]benzenecarbonitrile

Systemtic Name: 3-[3-[3-(1H-indol-3-yl)-1-oxidanylidene-1-piperazin-1-yl-propan-2-yl]-2-(3-methylphenyl)imino-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 3-[3-[1-(1H-indol-3-ylmethyl)-2-oxo-2-piperazin-1-yl-ethyl]-2-(m-tolylimino)thiazol-4-yl]benzonitrile CAS Name: 3-[3-[3-(1H-indol-3-yl)-1-oxo-1-(1-piperazinyl)propan-2-yl]-2-(3-methylphenyl)imino-4-thiazolyl]benzonitrile IUPAC Name: 3-[3-[3-(1H-indol-3-yl)-1-oxo-1-piperazin-1-ylpropan-2-yl]-2-(3-methylphenyl)imino-1,3-thiazol-4-yl]benzonitrile Traditional Name: 3-[3-[1-(1H-indol-3-ylmethyl)-2-keto-2-piperazino-ethyl]-2-(m-tolylimino)-4-thiazolin-4-yl]benzonitrile Formula: C32H30N6OS MolecularWeight: 546.6852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N=C2N(C(=CS2)C3=CC=CC(=C3)C#N)C(CC4=CNC5=CC=CC=C54)C(=O)N6CCNCC6

Isomeric SMILES

CC1=CC(=CC=C1)N=C2N(C(=CS2)C3=CC=CC(=C3)C#N)C(CC4=CNC5=CC=CC=C54)C(=O)N6CCNCC6

InChI

InChI=1S/C32H30N6OS/c1-22-6-4-9-26(16-22)36-32-38(30(21-40-32)24-8-5-7-23(17-24)19-33)29(31(39)37-14-12-34-13-15-37)18-25-20-35-28-11-3-2-10-27(25)28/h2-11,16-17,20-21,29,34-35H,12-15,18H2,1H3