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

Systemtic Name: 2-[(1-butyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one Openeye Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one CAS Name: 2-[(1-butyl-5-tetrazolyl)methylthio]-3-cyclopropyl-4-quinazolinone IUPAC Name: 2-[(1-butyltetrazol-5-yl)methylsulfanyl]-3-cyclopropylquinazolin-4-one Traditional Name: 2-[(1-butyltetrazol-5-yl)methylthio]-3-cyclopropyl-quinazolin-4-one Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

CCCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C17H20N6OS/c1-2-3-10-22-15(19-20-21-22)11-25-17-18-14-7-5-4-6-13(14)16(24)23(17)12-8-9-12/h4-7,12H,2-3,8-11H2,1H3