4-[2-(4-chloranylbutanoylamino)-3-phenyl-propanoyl]-N-(3-chlorophenyl)-2-methyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-(4-chloranylbutanoylamino)-3-phenyl-propanoyl]-N-(3-chlorophenyl)-2-methyl-piperazine-1-carboxamide Openeye Name: 4-[2-(4-chlorobutanoylamino)-3-phenyl-propanoyl]-N-(3-chlorophenyl)-2-methyl-piperazine-1-carboxamide CAS Name: 4-[2-[(4-chloro-1-oxobutyl)amino]-1-oxo-3-phenylpropyl]-N-(3-chlorophenyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: 4-[2-(4-chlorobutanoylamino)-3-phenylpropanoyl]-N-(3-chlorophenyl)-2-methylpiperazine-1-carboxamide Traditional Name: 4-[2-(4-chlorobutanoylamino)-3-phenyl-propanoyl]-N-(3-chlorophenyl)-2-methyl-piperazine-1-carboxamide Formula: C25H30Cl2N4O3 MolecularWeight: 505.4367

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC(=CC=C2)Cl)C(=O)C(CC3=CC=CC=C3)NC(=O)CCCCl

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC(=CC=C2)Cl)C(=O)C(CC3=CC=CC=C3)NC(=O)CCCCl

InChI

InChI=1S/C25H30Cl2N4O3/c1-18-17-30(13-14-31(18)25(34)28-21-10-5-9-20(27)16-21)24(33)22(29-23(32)11-6-12-26)15-19-7-3-2-4-8-19/h2-5,7-10,16,18,22H,6,11-15,17H2,1H3,(H,28,34)(H,29,32)