N-[(1R)-1-(benzotriazol-1-yl)-3-methyl-butyl]benzenecarbothioamide

Systemtic Name: N-[(1R)-1-(benzotriazol-1-yl)-3-methyl-butyl]benzenecarbothioamide Openeye Name: N-[(1R)-1-(benzotriazol-1-yl)-3-methyl-butyl]benzenecarbothioamide CAS Name: N-[(1R)-1-(1-benzotriazolyl)-3-methylbutyl]benzenecarbothioamide IUPAC Name: N-[(1R)-1-(benzotriazol-1-yl)-3-methylbutyl]benzenecarbothioamide Traditional Name: N-[(1R)-1-(benzotriazol-1-yl)-3-methyl-butyl]thiobenzamide Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@H](NC(=S)C1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H20N4S/c1-13(2)12-17(19-18(23)14-8-4-3-5-9-14)22-16-11-7-6-10-15(16)20-21-22/h3-11,13,17H,12H2,1-2H3,(H,19,23)/t17-/m1/s1