(E)-1-[4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonylpiperidin-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonylpiperidin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]-1-piperidyl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-[[4-(1-azepanylsulfonyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]piperidin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]piperidino]-3-phenyl-prop-2-en-1-one Formula: C25H36N4O4S MolecularWeight: 488.64274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H36N4O4S/c30-24(11-10-22-8-4-3-5-9-22)26-16-12-23(13-17-26)25(31)27-18-20-29(21-19-27)34(32,33)28-14-6-1-2-7-15-28/h3-5,8-11,23H,1-2,6-7,12-21H2/b11-10+