(E)-N-[1-[4-(diphenylmethyl)piperazin-1-yl]sulfonylpropyl]-3-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[1-[4-(diphenylmethyl)piperazin-1-yl]sulfonylpropyl]-3-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-N-[1-(4-benzhydrylpiperazin-1-yl)sulfonylpropyl]-3-(3-pyridyl)prop-2-enamide CAS Name: (E)-N-[1-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]propyl]-3-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-N-[1-(4-benzhydrylpiperazin-1-yl)sulfonylpropyl]-3-pyridin-3-ylprop-2-enamide Traditional Name: (E)-N-[1-(4-benzhydrylpiperazino)sulfonylpropyl]-3-(3-pyridyl)acrylamide Formula: C28H32N4O3S MolecularWeight: 504.64368

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)C=CC1=CN=CC=C1)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(NC(=O)/C=C/C1=CN=CC=C1)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H32N4O3S/c1-2-27(30-26(33)16-15-23-10-9-17-29-22-23)36(34,35)32-20-18-31(19-21-32)28(24-11-5-3-6-12-24)25-13-7-4-8-14-25/h3-17,22,27-28H,2,18-21H2,1H3,(H,30,33)/b16-15+