N,3-diethyl-4-oxidanylidene-N-[(4-phenylmethoxyphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N,3-diethyl-4-oxidanylidene-N-[(4-phenylmethoxyphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(4-benzyloxyphenyl)methyl]-N,3-diethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N,3-diethyl-4-oxo-N-[(4-phenylmethoxyphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N,3-diethyl-4-oxo-N-[(4-phenylmethoxyphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(4-benzoxybenzyl)-N,3-diethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(CC)CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(CC)CC3=CC=C(C=C3)OCC4=CC=CC=C4)NC1=S

InChI

InChI=1S/C27H27N3O3S/c1-3-29(17-19-10-13-22(14-11-19)33-18-20-8-6-5-7-9-20)25(31)21-12-15-23-24(16-21)28-27(34)30(4-2)26(23)32/h5-16H,3-4,17-18H2,1-2H3,(H,28,34)