methyl 3-[[3-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-methoxy-phenyl]carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[3-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-methoxy-phenyl]carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[3-[(3,5-dimethyl-1-piperidyl)sulfonyl]-4-methoxy-benzoyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[[3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-4-methoxyphenyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[3-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-methoxybenzoyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[3-(3,5-dimethylpiperidino)sulfonyl-4-methoxy-benzoyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C23H30N2O6S2 MolecularWeight: 494.6241

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC(CC(=O)OC)C3=CC=CS3)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC(CC(=O)OC)C3=CC=CS3)OC)C

InChI

InChI=1S/C23H30N2O6S2/c1-15-10-16(2)14-25(13-15)33(28,29)21-11-17(7-8-19(21)30-3)23(27)24-18(12-22(26)31-4)20-6-5-9-32-20/h5-9,11,15-16,18H,10,12-14H2,1-4H3,(H,24,27)