ethyl 4-methyl-2-oxidanylidene-6-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-oxidanylidene-6-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[allyl(2-thienylmethyl)amino]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-6-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-oxo-6-[[prop-2-enyl(thiophen-2-ylmethyl)amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[allyl(2-thenyl)amino]methyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CN(CC=C)CC2=CC=CS2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)CN(CC=C)CC2=CC=CS2

InChI

InChI=1S/C17H23N3O3S/c1-4-8-20(10-13-7-6-9-24-13)11-14-15(16(21)23-5-2)12(3)18-17(22)19-14/h4,6-7,9,12H,1,5,8,10-11H2,2-3H3,(H2,18,19,22)