methyl 2-[2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-1-yl)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-1-yl)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2,4-dimethyl-6-oxo-pyrimidin-1-yl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-(2,4-dimethyl-6-oxo-1-pyrimidinyl)-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2,4-dimethyl-6-oxopyrimidin-1-yl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(6-keto-2,4-dimethyl-pyrimidin-1-yl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CN3C(=NC(=CC3=O)C)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CN3C(=NC(=CC3=O)C)C

InChI

InChI=1S/C19H23N3O4S/c1-10-5-6-13-14(7-10)27-18(17(13)19(25)26-4)21-15(23)9-22-12(3)20-11(2)8-16(22)24/h8,10H,5-7,9H2,1-4H3,(H,21,23)