6-methyl-3-[(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-butan-2-yl]sulfanyl-1,2,4-triazin-5-olate

Systemtic Name: 6-methyl-3-[(2R)-1-(naphthalen-1-ylamino)-1-oxidanylidene-butan-2-yl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 6-methyl-3-[(1R)-1-(1-naphthylcarbamoyl)propyl]sulfanyl-1,2,4-triazin-5-olate CAS Name: 6-methyl-3-[[(2R)-1-(1-naphthalenylamino)-1-oxobutan-2-yl]thio]-1,2,4-triazin-5-olate IUPAC Name: 6-methyl-3-[(2R)-1-(naphthalen-1-ylamino)-1-oxobutan-2-yl]sulfanyl-1,2,4-triazin-5-olate Traditional Name: 6-methyl-3-[[(1R)-1-(1-naphthylcarbamoyl)propyl]thio]-1,2,4-triazin-5-olate Formula: C18H17N4O2S- MolecularWeight: 353.41818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=C(N=N3)C)[O-]

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC(=C(N=N3)C)[O-]

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)/p-1/t15-/m1/s1