N-(3,4-dichlorophenyl)-4-[3-methyl-2-(2-phenylbutanoylamino)pentanoyl]piperazine-1-carboxamide

Systemtic Name: N-(3,4-dichlorophenyl)-4-[3-methyl-2-(2-phenylbutanoylamino)pentanoyl]piperazine-1-carboxamide Openeye Name: N-(3,4-dichlorophenyl)-4-[3-methyl-2-(2-phenylbutanoylamino)pentanoyl]piperazine-1-carboxamide CAS Name: N-(3,4-dichlorophenyl)-4-[3-methyl-1-oxo-2-[(1-oxo-2-phenylbutyl)amino]pentyl]-1-piperazinecarboxamide IUPAC Name: N-(3,4-dichlorophenyl)-4-[3-methyl-2-(2-phenylbutanoylamino)pentanoyl]piperazine-1-carboxamide Traditional Name: N-(3,4-dichlorophenyl)-4-[3-methyl-2-(2-phenylbutanoylamino)pentanoyl]piperazine-1-carboxamide Formula: C27H34Cl2N4O3 MolecularWeight: 533.48986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)NC(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)NC(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C27H34Cl2N4O3/c1-4-18(3)24(31-25(34)21(5-2)19-9-7-6-8-10-19)26(35)32-13-15-33(16-14-32)27(36)30-20-11-12-22(28)23(29)17-20/h6-12,17-18,21,24H,4-5,13-16H2,1-3H3,(H,30,36)(H,31,34)