2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]-4-oxo-3-phenethyl-quinazoline-7-carboxamide CAS Name: 2-[(3-chlorophenyl)methylthio]-N-[2-(1-cyclohexenyl)ethyl]-4-oxo-3-phenethyl-7-quinazolinecarboxamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]-4-oxo-3-phenethylquinazoline-7-carboxamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N-[2-(cyclohexen-1-yl)ethyl]-4-keto-3-phenethyl-quinazoline-7-carboxamide Formula: C32H32ClN3O2S MolecularWeight: 558.13338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)CCC5=CC=CC=C5

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)CCC5=CC=CC=C5

InChI

InChI=1S/C32H32ClN3O2S/c33-27-13-7-12-25(20-27)22-39-32-35-29-21-26(30(37)34-18-16-23-8-3-1-4-9-23)14-15-28(29)31(38)36(32)19-17-24-10-5-2-6-11-24/h2,5-8,10-15,20-21H,1,3-4,9,16-19,22H2,(H,34,37)