1-(4-methylphenyl)sulfonyl-3-[4-[(E)-3-(6-piperidin-1-ylpyridin-2-yl)prop-2-enoyl]phenyl]urea

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-[4-[(E)-3-(6-piperidin-1-ylpyridin-2-yl)prop-2-enoyl]phenyl]urea Openeye Name: 1-[4-[(E)-3-[6-(1-piperidyl)-2-pyridyl]prop-2-enoyl]phenyl]-3-(p-tolylsulfonyl)urea CAS Name: 1-(4-methylphenyl)sulfonyl-3-[4-[(E)-1-oxo-3-[6-(1-piperidinyl)-2-pyridinyl]prop-2-enyl]phenyl]urea IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-[4-[(E)-3-(6-piperidin-1-ylpyridin-2-yl)prop-2-enoyl]phenyl]urea Traditional Name: 1-[4-[(E)-3-(6-piperidino-2-pyridyl)acryloyl]phenyl]-3-tosyl-urea Formula: C27H28N4O4S MolecularWeight: 504.60062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)C=CC3=NC(=CC=C3)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2=CC=C(C=C2)C(=O)/C=C/C3=NC(=CC=C3)N4CCCCC4

InChI

InChI=1S/C27H28N4O4S/c1-20-8-15-24(16-9-20)36(34,35)30-27(33)29-23-12-10-21(11-13-23)25(32)17-14-22-6-5-7-26(28-22)31-18-3-2-4-19-31/h5-17H,2-4,18-19H2,1H3,(H2,29,30,33)/b17-14+