4-azanyl-N-(1H-indazol-5-yl)-2-(3-methylsulfanylphenyl)butanamide

Systemtic Name: 4-azanyl-N-(1H-indazol-5-yl)-2-(3-methylsulfanylphenyl)butanamide Openeye Name: 4-amino-N-(1H-indazol-5-yl)-2-(3-methylsulfanylphenyl)butanamide CAS Name: 4-amino-N-(1H-indazol-5-yl)-2-[3-(methylthio)phenyl]butanamide IUPAC Name: 4-amino-N-(1H-indazol-5-yl)-2-(3-methylsulfanylphenyl)butanamide Traditional Name: 4-amino-N-(1H-indazol-5-yl)-2-[3-(methylthio)phenyl]butyramide Formula: C18H20N4OS MolecularWeight: 340.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)C(CCN)C(=O)NC2=CC3=C(C=C2)NN=C3

Isomeric SMILES

CSC1=CC=CC(=C1)C(CCN)C(=O)NC2=CC3=C(C=C2)NN=C3

InChI

InChI=1S/C18H20N4OS/c1-24-15-4-2-3-12(10-15)16(7-8-19)18(23)21-14-5-6-17-13(9-14)11-20-22-17/h2-6,9-11,16H,7-8,19H2,1H3,(H,20,22)(H,21,23)