2-[5-azanyl-4-(phenylsulfonyl)-1,2,3-triazol-1-yl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[5-azanyl-4-(phenylsulfonyl)-1,2,3-triazol-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[5-amino-4-(benzenesulfonyl)triazol-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[5-amino-4-(benzenesulfonyl)-1-triazolyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[5-amino-4-(benzenesulfonyl)triazol-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-(5-amino-4-besyl-triazol-1-yl)-N-(2,6-dimethylphenyl)acetamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=C(N=N2)S(=O)(=O)C3=CC=CC=C3)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=C(N=N2)S(=O)(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C18H19N5O3S/c1-12-7-6-8-13(2)16(12)20-15(24)11-23-17(19)18(21-22-23)27(25,26)14-9-4-3-5-10-14/h3-10H,11,19H2,1-2H3,(H,20,24)