(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: (5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl 3-[(4-methylcyclohexyl)carbonyl-(1-methylpiperidin-4-yl)amino]-5-phenyl-thiophene-2-carboxylate Openeye Name: (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[(4-methylcyclohexyl)-oxomethyl]-(1-methyl-4-piperidinyl)amino]-5-phenyl-2-thiophenecarboxylic acid (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester IUPAC Name: (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 3-[(4-methylcyclohexanecarbonyl)-(1-methylpiperidin-4-yl)amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(4-methylcyclohexanecarbonyl)-(1-methyl-4-piperidyl)amino]-5-phenyl-thiophene-2-carboxylic acid (2-keto-5-methyl-1,3-dioxol-4-yl)methyl ester Formula: C30H36N2O6S MolecularWeight: 552.68164

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)OCC5=C(OC(=O)O5)C

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCN(CC2)C)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)OCC5=C(OC(=O)O5)C

InChI

InChI=1S/C30H36N2O6S/c1-19-9-11-22(12-10-19)28(33)32(23-13-15-31(3)16-14-23)24-17-26(21-7-5-4-6-8-21)39-27(24)29(34)36-18-25-20(2)37-30(35)38-25/h4-8,17,19,22-23H,9-16,18H2,1-3H3