2-(1,3-benzothiazol-2-ylsulfanyl)ethyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)ethyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)ethyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(1,3-benzothiazol-2-ylthio)ethyl ester IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)ethyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(1,3-benzothiazol-2-ylthio)ethyl ester Formula: C15H15N3O2S3 MolecularWeight: 365.4935

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H15N3O2S3/c1-9-10(8-16-14(21)17-9)13(19)20-6-7-22-15-18-11-4-2-3-5-12(11)23-15/h2-5H,6-8H2,1H3,(H2,16,17,21)