N-cyclohexyl-4-oxidanylidene-2-phenacylsulfanyl-3-phenyl-quinazoline-7-carboxamide

Systemtic Name: N-cyclohexyl-4-oxidanylidene-2-phenacylsulfanyl-3-phenyl-quinazoline-7-carboxamide Openeye Name: N-cyclohexyl-4-oxo-2-phenacylsulfanyl-3-phenyl-quinazoline-7-carboxamide CAS Name: N-cyclohexyl-4-oxo-2-(phenacylthio)-3-phenyl-7-quinazolinecarboxamide IUPAC Name: N-cyclohexyl-4-oxo-2-phenacylsulfanyl-3-phenylquinazoline-7-carboxamide Traditional Name: N-cyclohexyl-4-keto-2-(phenacylthio)-3-phenyl-quinazoline-7-carboxamide Formula: C29H27N3O3S MolecularWeight: 497.60798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H27N3O3S/c33-26(20-10-4-1-5-11-20)19-36-29-31-25-18-21(27(34)30-22-12-6-2-7-13-22)16-17-24(25)28(35)32(29)23-14-8-3-9-15-23/h1,3-5,8-11,14-18,22H,2,6-7,12-13,19H2,(H,30,34)