N-[4-[4-(diphenylmethyl)piperazin-1-yl]-3-pyridin-3-yl-butyl]-2-methylidene-butanamide

Systemtic Name: N-[4-[4-(diphenylmethyl)piperazin-1-yl]-3-pyridin-3-yl-butyl]-2-methylidene-butanamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)-3-(3-pyridyl)butyl]-2-methylene-butanamide CAS Name: N-[4-[4-(diphenylmethyl)-1-piperazinyl]-3-(3-pyridinyl)butyl]-2-methylenebutanamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)-3-pyridin-3-ylbutyl]-2-methylidenebutanamide Traditional Name: N-[4-(4-benzhydrylpiperazino)-3-(3-pyridyl)butyl]-2-ethyl-acrylamide Formula: C31H38N4O MolecularWeight: 482.65962

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)C(=O)NCCC(CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CCC(=C)C(=O)NCCC(CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C31H38N4O/c1-3-25(2)31(36)33-18-16-29(28-15-10-17-32-23-28)24-34-19-21-35(22-20-34)30(26-11-6-4-7-12-26)27-13-8-5-9-14-27/h4-15,17,23,29-30H,2-3,16,18-22,24H2,1H3,(H,33,36)