3-[[4-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-2-propan-2-yl-3H-isoindol-1-one

Systemtic Name: 3-[[4-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]amino]-2-propan-2-yl-3H-isoindol-1-one Openeye Name: 3-[4-(4-benzhydrylpiperazine-1-carbonyl)anilino]-2-isopropyl-isoindolin-1-one CAS Name: 3-[4-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]anilino]-2-propan-2-yl-3H-isoindol-1-one IUPAC Name: 3-[4-(4-benzhydrylpiperazine-1-carbonyl)anilino]-2-propan-2-yl-3H-isoindol-1-one Traditional Name: 3-[4-(4-benzhydrylpiperazine-1-carbonyl)anilino]-2-isopropyl-isoindolin-1-one Formula: C35H36N4O2 MolecularWeight: 544.68594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)N1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)C(=O)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H36N4O2/c1-25(2)39-33(30-15-9-10-16-31(30)35(39)41)36-29-19-17-28(18-20-29)34(40)38-23-21-37(22-24-38)32(26-11-5-3-6-12-26)27-13-7-4-8-14-27/h3-20,25,32-33,36H,21-24H2,1-2H3