2-[2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: 2-[2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: 2-[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetamide CAS Name: 2-[2-[[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]methyl]-4-oxo-3-quinazolinyl]acetamide IUPAC Name: 2-[2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-oxoquinazolin-3-yl]acetamide Traditional Name: 2-[2-[[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]methyl]-4-keto-quinazolin-3-yl]acetamide Formula: C19H23N7O2S MolecularWeight: 413.49662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C19H23N7O2S/c20-15(27)10-25-16(22-14-9-5-4-8-13(14)18(25)28)11-29-19-24-23-17(26(19)21)12-6-2-1-3-7-12/h4-5,8-9,12H,1-3,6-7,10-11,21H2,(H2,20,27)