5-bromanyl-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]thiocarbamoyl]-1-naphthamide Formula: C16H14BrN5OS2 MolecularWeight: 436.34926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)SC

Isomeric SMILES

CC1=NN=C(N1NC(=S)NC(=O)C2=CC=CC3=C2C=CC=C3Br)SC

InChI

InChI=1S/C16H14BrN5OS2/c1-9-19-20-16(25-2)22(9)21-15(24)18-14(23)12-7-3-6-11-10(12)5-4-8-13(11)17/h3-8H,1-2H3,(H2,18,21,23,24)