N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-2-[(8-methoxy-4-methyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-2-(8-methoxy-4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[(8-methoxy-4-methyl-2-quinolyl)thio]butyramide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=NN1C)C#N)SC2=NC3=C(C=CC=C3OC)C(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=NN1C)C#N)SC2=NC3=C(C=CC=C3OC)C(=C2)C

InChI

InChI=1S/C20H21N5O2S/c1-5-16(20(26)24-19-13(10-21)11-22-25(19)3)28-17-9-12(2)14-7-6-8-15(27-4)18(14)23-17/h6-9,11,16H,5H2,1-4H3,(H,24,26)