ethyl 4-oxidanylidene-1,3-diphenyl-6-[(phenylmethyl)amino]-2-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-1,3-diphenyl-6-[(phenylmethyl)amino]-2-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(benzylamino)-6-oxo-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylate CAS Name: 4-oxo-1,3-diphenyl-6-[(phenylmethyl)amino]-2-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-6-oxo-1,3-diphenyl-2-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 4-(benzylamino)-6-keto-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylic acid ethyl ester Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3S/c1-2-32-25(31)22-23(27-18-19-12-6-3-7-13-19)28(20-14-8-4-9-15-20)26(33)29(24(22)30)21-16-10-5-11-17-21/h3-17,27H,2,18H2,1H3