ethyl 2-oxidanylidene-6-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-6-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H17N5O3S2 MolecularWeight: 391.46788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NN=C(S2)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CSC2=NN=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C16H17N5O3S2/c1-2-24-13(22)11-8-17-14(23)19-12(11)9-25-16-21-20-15(26-16)18-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,18,20)(H2,17,19,23)