methyl 5-methyl-2-[[(2R)-2-methylpiperidin-1-yl]carbothioylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[[(2R)-2-methylpiperidin-1-yl]carbothioylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[[(2R)-2-methylpiperidine-1-carbothioyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[(2R)-2-methyl-1-piperidinyl]-sulfanylidenemethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[[(2R)-2-methylpiperidine-1-carbothioyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-2-[[(2R)-2-methylpiperidine-1-carbothioyl]amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C20H24N2O2S2 MolecularWeight: 388.54676

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=S)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

C[C@@H]1CCCCN1C(=S)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H24N2O2S2/c1-13-9-7-8-12-22(13)20(25)21-18-17(19(23)24-3)16(14(2)26-18)15-10-5-4-6-11-15/h4-6,10-11,13H,7-9,12H2,1-3H3,(H,21,25)/t13-/m1/s1