7-chloranyl-3-cyclohexyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-cyclohexyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-cyclohexyl-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-cyclohexyl-2-[(1-phenyl-5-tetrazolyl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-cyclohexyl-2-[(1-phenyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-cyclohexyl-2-[(1-phenyltetrazol-5-yl)methylthio]quinazolin-4-one Formula: C22H21ClN6OS MolecularWeight: 452.95974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C22H21ClN6OS/c23-15-11-12-18-19(13-15)24-22(28(21(18)30)16-7-3-1-4-8-16)31-14-20-25-26-27-29(20)17-9-5-2-6-10-17/h2,5-6,9-13,16H,1,3-4,7-8,14H2