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

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(3-methoxyphenyl)-4-oxidanylidene-N-propan-2-yl-quinazoline-7-carboxamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-isopropyl-3-(3-methoxyphenyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(3-chlorophenyl)methylthio]-3-(3-methoxyphenyl)-4-oxo-N-propan-2-yl-7-quinazolinecarboxamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-(3-methoxyphenyl)-4-oxo-N-propan-2-ylquinazoline-7-carboxamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N-isopropyl-4-keto-3-(3-methoxyphenyl)quinazoline-7-carboxamide Formula: C26H24ClN3O3S MolecularWeight: 494.00506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24ClN3O3S/c1-16(2)28-24(31)18-10-11-22-23(13-18)29-26(34-15-17-6-4-7-19(27)12-17)30(25(22)32)20-8-5-9-21(14-20)33-3/h4-14,16H,15H2,1-3H3,(H,28,31)