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

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-N,N-diethyl-3-(4-methoxyphenyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-N,N-diethyl-3-(4-methoxyphenyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(2-chlorophenyl)methylthio]-N,N-diethyl-3-(4-methoxyphenyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-N,N-diethyl-3-(4-methoxyphenyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[(2-chlorobenzyl)thio]-N,N-diethyl-4-keto-3-(4-methoxyphenyl)quinazoline-7-carboxamide Formula: C27H26ClN3O3S MolecularWeight: 508.03164

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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=C3Cl)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=CC=C3Cl)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H26ClN3O3S/c1-4-30(5-2)25(32)18-10-15-22-24(16-18)29-27(35-17-19-8-6-7-9-23(19)28)31(26(22)33)20-11-13-21(34-3)14-12-20/h6-16H,4-5,17H2,1-3H3