2-[(1S)-1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1S)-1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1S)-1-(1-cyclohexyltetrazol-5-yl)sulfanylethyl]-1H-quinazolin-4-one CAS Name: 2-[(1S)-1-[(1-cyclohexyl-5-tetrazolyl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1S)-1-(1-cyclohexyltetrazol-5-yl)sulfanylethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1S)-1-[(1-cyclohexyltetrazol-5-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)SC3=NN=NN3C4CCCCC4

Isomeric SMILES

C[C@@H](C1=NC(=O)C2=CC=CC=C2N1)SC3=NN=NN3C4CCCCC4

InChI

InChI=1S/C17H20N6OS/c1-11(15-18-14-10-6-5-9-13(14)16(24)19-15)25-17-20-21-22-23(17)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,18,19,24)/t11-/m0/s1