N-[1-[4-(2,4-dichlorophenyl)carbonyl-3-methyl-piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-ethyl-benzamide

Systemtic Name: N-[1-[4-(2,4-dichlorophenyl)carbonyl-3-methyl-piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-ethyl-benzamide Openeye Name: N-[1-benzyl-2-[4-(2,4-dichlorobenzoyl)-3-methyl-piperazin-1-yl]-2-oxo-ethyl]-4-ethyl-benzamide CAS Name: N-[1-[4-[(2,4-dichlorophenyl)-oxomethyl]-3-methyl-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]-4-ethylbenzamide IUPAC Name: N-[1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]-4-ethylbenzamide Traditional Name: N-[1-benzyl-2-[4-(2,4-dichlorobenzoyl)-3-methyl-piperazino]-2-keto-ethyl]-4-ethyl-benzamide Formula: C30H31Cl2N3O3 MolecularWeight: 552.49144

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N3CCN(C(C3)C)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N3CCN(C(C3)C)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C30H31Cl2N3O3/c1-3-21-9-11-23(12-10-21)28(36)33-27(17-22-7-5-4-6-8-22)30(38)34-15-16-35(20(2)19-34)29(37)25-14-13-24(31)18-26(25)32/h4-14,18,20,27H,3,15-17,19H2,1-2H3,(H,33,36)