[4-[(2-methoxy-5-propan-2-yl-phenyl)methyl]piperazin-1-yl]-(2-phenylazanylpyridin-3-yl)methanone

Systemtic Name: [4-[(2-methoxy-5-propan-2-yl-phenyl)methyl]piperazin-1-yl]-(2-phenylazanylpyridin-3-yl)methanone Openeye Name: (2-anilino-3-pyridyl)-[4-[(5-isopropyl-2-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (2-anilino-3-pyridinyl)-[4-[(2-methoxy-5-propan-2-ylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (2-anilinopyridin-3-yl)-[4-[(2-methoxy-5-propan-2-ylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (2-anilino-3-pyridyl)-[4-(5-isopropyl-2-methoxy-benzyl)piperazino]methanone Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=C(N=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=C(N=CC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C27H32N4O2/c1-20(2)21-11-12-25(33-3)22(18-21)19-30-14-16-31(17-15-30)27(32)24-10-7-13-28-26(24)29-23-8-5-4-6-9-23/h4-13,18,20H,14-17,19H2,1-3H3,(H,28,29)