N-[6-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-propan-2-yl-2-(4-propan-2-ylphenyl)benzamide

Systemtic Name: N-[6-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-propan-2-yl-2-(4-propan-2-ylphenyl)benzamide Openeye Name: N-[6-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]-3-pyridyl]-3-isopropyl-2-(4-isopropylphenyl)benzamide CAS Name: N-[6-[4-[(3-cyanophenyl)methyl]-1-piperazinyl]-3-pyridinyl]-3-propan-2-yl-2-(4-propan-2-ylphenyl)benzamide IUPAC Name: N-[6-[4-[(3-cyanophenyl)methyl]piperazin-1-yl]pyridin-3-yl]-3-propan-2-yl-2-(4-propan-2-ylphenyl)benzamide Traditional Name: N-[6-[4-(3-cyanobenzyl)piperazino]-3-pyridyl]-3-isopropyl-2-p-cumenyl-benzamide Formula: C36H39N5O MolecularWeight: 557.72776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(C=CC=C2C(C)C)C(=O)NC3=CN=C(C=C3)N4CCN(CC4)CC5=CC=CC(=C5)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(C=CC=C2C(C)C)C(=O)NC3=CN=C(C=C3)N4CCN(CC4)CC5=CC=CC(=C5)C#N

InChI

InChI=1S/C36H39N5O/c1-25(2)29-11-13-30(14-12-29)35-32(26(3)4)9-6-10-33(35)36(42)39-31-15-16-34(38-23-31)41-19-17-40(18-20-41)24-28-8-5-7-27(21-28)22-37/h5-16,21,23,25-26H,17-20,24H2,1-4H3,(H,39,42)