4-[2-[(4-butylphenyl)carbonylamino]-3-methyl-pentanoyl]-2-methyl-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[(4-butylphenyl)carbonylamino]-3-methyl-pentanoyl]-2-methyl-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-[(4-butylbenzoyl)amino]-3-methyl-pentanoyl]-2-methyl-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-[[(4-butylphenyl)-oxomethyl]amino]-3-methyl-1-oxopentyl]-2-methyl-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-[(4-butylbenzoyl)amino]-3-methylpentanoyl]-2-methyl-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-[(4-butylbenzoyl)amino]-3-methyl-pentanoyl]-2-methyl-N-phenyl-piperazine-1-carboxamide Formula: C29H40N4O3 MolecularWeight: 492.6529

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(C(C)CC)C(=O)N2CCN(C(C2)C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC(C(C)CC)C(=O)N2CCN(C(C2)C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C29H40N4O3/c1-5-7-11-23-14-16-24(17-15-23)27(34)31-26(21(3)6-2)28(35)32-18-19-33(22(4)20-32)29(36)30-25-12-9-8-10-13-25/h8-10,12-17,21-22,26H,5-7,11,18-20H2,1-4H3,(H,30,36)(H,31,34)