methyl 3-cyclopropyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-cyclopropyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-cyclopropyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-cyclopropyl-4-[[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-cyclopropyl-4-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-cyclopropyl-4-[[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-2-keto-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C20H22N4O3S3 MolecularWeight: 462.60868

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)SCC2=C(C(NC(=O)N2C3CC3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCSC1=NN=C(S1)SCC2=C(C(NC(=O)N2C3CC3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C20H22N4O3S3/c1-3-28-19-22-23-20(30-19)29-11-14-15(17(25)27-2)16(12-7-5-4-6-8-12)21-18(26)24(14)13-9-10-13/h4-8,13,16H,3,9-11H2,1-2H3,(H,21,26)