methyl 4-methyl-2-oxidanylidene-3-(phenylmethyl)-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-methyl-2-oxidanylidene-3-(phenylmethyl)-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-benzyl-4-methyl-2-oxo-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-3-(phenylmethyl)-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-benzyl-4-methyl-2-oxo-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-benzyl-2-keto-4-methyl-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CSC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CSC=C3)C(=O)OC

InChI

InChI=1S/C18H18N2O3S/c1-12-15(17(21)23-2)16(14-8-9-24-11-14)19-18(22)20(12)10-13-6-4-3-5-7-13/h3-9,11,16H,10H2,1-2H3,(H,19,22)