N-(2-azanyl-5-phenyl-phenyl)-4-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-4-[(phenylmethyl)amino]butyl]benzamide

Systemtic Name: N-(2-azanyl-5-phenyl-phenyl)-4-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-4-[(phenylmethyl)amino]butyl]benzamide Openeye Name: N-(2-amino-5-phenyl-phenyl)-4-[4-(benzylamino)-3-(4-methylpiperazin-1-yl)-4-oxo-butyl]benzamide CAS Name: N-(2-amino-5-phenylphenyl)-4-[3-(4-methyl-1-piperazinyl)-4-oxo-4-[(phenylmethyl)amino]butyl]benzamide IUPAC Name: N-(2-amino-5-phenylphenyl)-4-[4-(benzylamino)-3-(4-methylpiperazin-1-yl)-4-oxobutyl]benzamide Traditional Name: N-(2-amino-5-phenyl-phenyl)-4-[4-(benzylamino)-4-keto-3-(4-methylpiperazino)butyl]benzamide Formula: C35H39N5O2 MolecularWeight: 561.71646

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CC=C4)N)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C(CCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CC=C4)N)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C35H39N5O2/c1-39-20-22-40(23-21-39)33(35(42)37-25-27-8-4-2-5-9-27)19-14-26-12-15-29(16-13-26)34(41)38-32-24-30(17-18-31(32)36)28-10-6-3-7-11-28/h2-13,15-18,24,33H,14,19-23,25,36H2,1H3,(H,37,42)(H,38,41)