2-methylsulfanylethyl (4R,5S)-4-(4-dimethylaminophenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: 2-methylsulfanylethyl (4R,5S)-4-(4-dimethylaminophenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: 2-methylsulfanylethyl (4R,5S)-4-(4-dimethylaminophenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-(4-dimethylaminophenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid 2-(methylthio)ethyl ester IUPAC Name: 2-methylsulfanylethyl (4R,5S)-4-(4-dimethylaminophenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-(4-dimethylaminophenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OCCSC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H]2[C@@H](C(=C)NC(=O)N2)C(=O)OCCSC

InChI

InChI=1S/C17H23N3O3S/c1-11-14(16(21)23-9-10-24-4)15(19-17(22)18-11)12-5-7-13(8-6-12)20(2)3/h5-8,14-15H,1,9-10H2,2-4H3,(H2,18,19,22)/t14-,15+/m1/s1