methyl 4-[2-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl)carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl)carbonylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(4-oxo-2-thioxo-1H-quinazoline-7-carbonyl)amino]thiazol-4-yl]-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[[oxo-(4-oxo-2-sulfanylidene-1H-quinazolin-7-yl)methyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-oxo-2-sulfanylidene-1H-quinazoline-7-carbonyl)amino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[(4-keto-2-thioxo-1H-quinazoline-7-carbonyl)amino]thiazol-4-yl]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C18H13N5O4S2 MolecularWeight: 427.45692

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)C(=O)NC(=S)N4

Isomeric SMILES

COC(=O)C1=CC(=CN1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)C(=O)NC(=S)N4

InChI

InChI=1S/C18H13N5O4S2/c1-27-16(26)12-5-9(6-19-12)13-7-29-18(21-13)23-14(24)8-2-3-10-11(4-8)20-17(28)22-15(10)25/h2-7,19H,1H3,(H,21,23,24)(H2,20,22,25,28)