N-methyl-N-[2-(2-methylphenyl)-1-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]ethyl]cyclobutanecarboxamide

Systemtic Name: N-methyl-N-[2-(2-methylphenyl)-1-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]ethyl]cyclobutanecarboxamide Openeye Name: N-methyl-N-[2-(o-tolyl)-1-[1-[(E)-3-(2-thienyl)prop-2-enoyl]-4-piperidyl]ethyl]cyclobutanecarboxamide CAS Name: N-methyl-N-[2-(2-methylphenyl)-1-[1-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-4-piperidinyl]ethyl]cyclobutanecarboxamide IUPAC Name: N-methyl-N-[2-(2-methylphenyl)-1-[1-[(E)-3-thiophen-2-ylprop-2-enoyl]piperidin-4-yl]ethyl]cyclobutanecarboxamide Traditional Name: N-methyl-N-[2-(o-tolyl)-1-[1-[(E)-3-(2-thienyl)acryloyl]-4-piperidyl]ethyl]cyclobutanecarboxamide Formula: C27H34N2O2S MolecularWeight: 450.63606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(C2CCN(CC2)C(=O)C=CC3=CC=CS3)N(C)C(=O)C4CCC4

Isomeric SMILES

CC1=CC=CC=C1CC(C2CCN(CC2)C(=O)/C=C/C3=CC=CS3)N(C)C(=O)C4CCC4

InChI

InChI=1S/C27H34N2O2S/c1-20-7-3-4-8-23(20)19-25(28(2)27(31)22-9-5-10-22)21-14-16-29(17-15-21)26(30)13-12-24-11-6-18-32-24/h3-4,6-8,11-13,18,21-22,25H,5,9-10,14-17,19H2,1-2H3/b13-12+