6-chloranyl-3-(2-methylpropyl)-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-(2-methylpropyl)-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 6-chloro-3-isobutyl-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one CAS Name: 6-chloro-3-(2-methylpropyl)-2-[(1-propyl-5-tetrazolyl)methylthio]-4-quinazolinone IUPAC Name: 6-chloro-3-(2-methylpropyl)-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 6-chloro-3-isobutyl-2-[(1-propyltetrazol-5-yl)methylthio]quinazolin-4-one Formula: C17H21ClN6OS MolecularWeight: 392.90624

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC(C)C

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC(C)C

InChI

InChI=1S/C17H21ClN6OS/c1-4-7-24-15(20-21-22-24)10-26-17-19-14-6-5-12(18)8-13(14)16(25)23(17)9-11(2)3/h5-6,8,11H,4,7,9-10H2,1-3H3