5-azanyl-3-methyl-1-(4,6,8-trimethylquinolin-2-yl)pyrazole-4-thiol

Systemtic Name: 5-azanyl-3-methyl-1-(4,6,8-trimethylquinolin-2-yl)pyrazole-4-thiol Openeye Name: 5-amino-3-methyl-1-(4,6,8-trimethyl-2-quinolyl)pyrazole-4-thiol CAS Name: 5-amino-3-methyl-1-(4,6,8-trimethyl-2-quinolinyl)-4-pyrazolethiol IUPAC Name: 5-amino-3-methyl-1-(4,6,8-trimethylquinolin-2-yl)pyrazole-4-thiol Traditional Name: 5-amino-3-methyl-1-(4,6,8-trimethyl-2-quinolyl)pyrazole-4-thiol Formula: C16H18N4S MolecularWeight: 298.40592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)N3C(=C(C(=N3)C)S)N)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)N3C(=C(C(=N3)C)S)N)C)C

InChI

InChI=1S/C16H18N4S/c1-8-5-10(3)14-12(6-8)9(2)7-13(18-14)20-16(17)15(21)11(4)19-20/h5-7,21H,17H2,1-4H3