N-(4-bromophenyl)-2-[4-(2-oxidanylidene-2-phenylazanyl-ethyl)piperazin-1-yl]propanamide

Systemtic Name: N-(4-bromophenyl)-2-[4-(2-oxidanylidene-2-phenylazanyl-ethyl)piperazin-1-yl]propanamide Openeye Name: 2-[4-(2-anilino-2-oxo-ethyl)piperazin-1-yl]-N-(4-bromophenyl)propanamide CAS Name: 2-[4-(2-anilino-2-oxoethyl)-1-piperazinyl]-N-(4-bromophenyl)propanamide IUPAC Name: 2-[4-(2-anilino-2-oxoethyl)piperazin-1-yl]-N-(4-bromophenyl)propanamide Traditional Name: 2-[4-(2-anilino-2-keto-ethyl)piperazino]-N-(4-bromophenyl)propionamide Formula: C21H25BrN4O2 MolecularWeight: 445.3528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Br)N2CCN(CC2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Br)N2CCN(CC2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25BrN4O2/c1-16(21(28)24-19-9-7-17(22)8-10-19)26-13-11-25(12-14-26)15-20(27)23-18-5-3-2-4-6-18/h2-10,16H,11-15H2,1H3,(H,23,27)(H,24,28)