N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]cyclopropanecarboxamide CAS Name: N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]cyclopropanecarboxamide Traditional Name: N-[4-(4-p-toluoylpiperazino)-3-(pyrrolidine-1-carbonyl)phenyl]cyclopropanecarboxamide Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4CC4)C(=O)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4CC4)C(=O)N5CCCC5

InChI

InChI=1S/C27H32N4O3/c1-19-4-6-21(7-5-19)26(33)31-16-14-29(15-17-31)24-11-10-22(28-25(32)20-8-9-20)18-23(24)27(34)30-12-2-3-13-30/h4-7,10-11,18,20H,2-3,8-9,12-17H2,1H3,(H,28,32)