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

Systemtic Name: methyl 5-methyl-4-oxidanylidene-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(5-anilino-1,3,4-thiadiazol-2-yl)thio]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C18H15N5O3S3 MolecularWeight: 445.5384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NN=C(S3)NC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NN=C(S3)NC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C18H15N5O3S3/c1-9-12-14(24)20-11(21-15(12)28-13(9)16(25)26-2)8-27-18-23-22-17(29-18)19-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,19,22)(H,20,21,24)