2-(cyanomethylsulfanyl)-N,3-dicyclohexyl-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N,3-dicyclohexyl-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-(cyanomethylsulfanyl)-N,3-dicyclohexyl-4-oxo-quinazoline-7-carboxamide CAS Name: 2-(cyanomethylthio)-N,3-dicyclohexyl-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-(cyanomethylsulfanyl)-N,3-dicyclohexyl-4-oxoquinazoline-7-carboxamide Traditional Name: 2-(cyanomethylthio)-N,3-dicyclohexyl-4-keto-quinazoline-7-carboxamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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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#N)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC#N)C4CCCCC4

InChI

InChI=1S/C23H28N4O2S/c24-13-14-30-23-26-20-15-16(21(28)25-17-7-3-1-4-8-17)11-12-19(20)22(29)27(23)18-9-5-2-6-10-18/h11-12,15,17-18H,1-10,14H2,(H,25,28)