2-[(3-chlorophenyl)methylsulfanyl]-N,N-diethyl-4-oxidanylidene-3-phenyl-quinazoline-7-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N,N-diethyl-4-oxidanylidene-3-phenyl-quinazoline-7-carboxamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N,N-diethyl-4-oxo-3-phenyl-quinazoline-7-carboxamide CAS Name: 2-[(3-chlorophenyl)methylthio]-N,N-diethyl-4-oxo-3-phenyl-7-quinazolinecarboxamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N,N-diethyl-4-oxo-3-phenylquinazoline-7-carboxamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N,N-diethyl-4-keto-3-phenyl-quinazoline-7-carboxamide Formula: C26H24ClN3O2S MolecularWeight: 478.00566

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C26H24ClN3O2S/c1-3-29(4-2)24(31)19-13-14-22-23(16-19)28-26(33-17-18-9-8-10-20(27)15-18)30(25(22)32)21-11-6-5-7-12-21/h5-16H,3-4,17H2,1-2H3