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

Systemtic Name: ethyl 2-oxidanylidene-4-phenyl-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-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-oxo-4-phenyl-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-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H21N5O3S2 MolecularWeight: 467.56384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NN=C(S3)NC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NN=C(S3)NC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3S2/c1-2-30-19(28)17-16(24-20(29)25-18(17)14-9-5-3-6-10-14)13-31-22-27-26-21(32-22)23-15-11-7-4-8-12-15/h3-12,18H,2,13H2,1H3,(H,23,26)(H2,24,25,29)