2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]-N-naphthalen-1-yl-butanamide

Systemtic Name: 2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]-N-naphthalen-1-yl-butanamide Openeye Name: 2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]-N-(1-naphthyl)butanamide CAS Name: 2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)thio]-N-(1-naphthalenyl)butanamide IUPAC Name: 2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]-N-naphthalen-1-ylbutanamide Traditional Name: 2-[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)thio]-N-(1-naphthyl)butyramide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=O)C(=NN3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=O)C(=NN3)C

InChI

InChI=1S/C18H18N4O2S/c1-3-15(25-18-20-16(23)11(2)21-22-18)17(24)19-14-10-6-8-12-7-4-5-9-13(12)14/h4-10,15H,3H2,1-2H3,(H,19,24)(H,20,22,23)