N-[1-(benzotriazol-1-yl)nonyl]benzenecarbothioamide

Systemtic Name: N-[1-(benzotriazol-1-yl)nonyl]benzenecarbothioamide Openeye Name: N-[1-(benzotriazol-1-yl)nonyl]benzenecarbothioamide CAS Name: N-[1-(1-benzotriazolyl)nonyl]benzenecarbothioamide IUPAC Name: N-[1-(benzotriazol-1-yl)nonyl]benzenecarbothioamide Traditional Name: N-[1-(benzotriazol-1-yl)nonyl]thiobenzamide Formula: C22H28N4S MolecularWeight: 380.54952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(NC(=S)C1=CC=CC=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCCCCCCC(NC(=S)C1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C22H28N4S/c1-2-3-4-5-6-10-17-21(23-22(27)18-13-8-7-9-14-18)26-20-16-12-11-15-19(20)24-25-26/h7-9,11-16,21H,2-6,10,17H2,1H3,(H,23,27)