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

Systemtic Name: 3-(4-ethylphenyl)-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(4-ethylphenyl)-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(4-ethylphenyl)-2-[(1-propyl-5-tetrazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(4-ethylphenyl)-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(4-ethylphenyl)-2-[(1-propyltetrazol-5-yl)methylthio]quinazolin-4-one Formula: C21H22N6OS MolecularWeight: 406.50398

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)CC

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)CC

InChI

InChI=1S/C21H22N6OS/c1-3-13-26-19(23-24-25-26)14-29-21-22-18-8-6-5-7-17(18)20(28)27(21)16-11-9-15(4-2)10-12-16/h5-12H,3-4,13-14H2,1-2H3