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

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-cyclohexyl-N-(3,4-dimethoxyphenyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-cyclohexyl-N-(3,4-dimethoxyphenyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(3-chlorophenyl)methylthio]-3-cyclohexyl-N-(3,4-dimethoxyphenyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-3-cyclohexyl-N-(3,4-dimethoxyphenyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[(3-chlorobenzyl)thio]-3-cyclohexyl-N-(3,4-dimethoxyphenyl)-4-keto-quinazoline-7-carboxamide Formula: C30H30ClN3O4S MolecularWeight: 564.0949

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)C5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC(=CC=C4)Cl)C5CCCCC5)OC

InChI

InChI=1S/C30H30ClN3O4S/c1-37-26-14-12-22(17-27(26)38-2)32-28(35)20-11-13-24-25(16-20)33-30(39-18-19-7-6-8-21(31)15-19)34(29(24)36)23-9-4-3-5-10-23/h6-8,11-17,23H,3-5,9-10,18H2,1-2H3,(H,32,35)