ethyl N-(ethoxycarbonylamino)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]carbamate

Systemtic Name: ethyl N-(ethoxycarbonylamino)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]carbamate Openeye Name: ethyl N-(ethoxycarbonylamino)-N-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]carbamate CAS Name: N-(ethoxycarbonylamino)-N-[(4-oxo-1H-quinazolin-2-yl)thio]carbamic acid ethyl ester IUPAC Name: ethyl N-(ethoxycarbonylamino)-N-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]carbamate Traditional Name: N-(carbethoxyamino)-N-[(4-keto-1H-quinazolin-2-yl)thio]carbamic acid ethyl ester Formula: C14H16N4O5S MolecularWeight: 352.36564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NN(C(=O)OCC)SC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CCOC(=O)NN(C(=O)OCC)SC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C14H16N4O5S/c1-3-22-13(20)17-18(14(21)23-4-2)24-12-15-10-8-6-5-7-9(10)11(19)16-12/h5-8H,3-4H2,1-2H3,(H,17,20)(H,15,16,19)