4-[(5-azanyl-1-cycloheptylcarbonyl-1,2,4-triazol-3-yl)amino]benzenesulfonamide

Systemtic Name: 4-[(5-azanyl-1-cycloheptylcarbonyl-1,2,4-triazol-3-yl)amino]benzenesulfonamide Openeye Name: 4-[[5-amino-1-(cycloheptanecarbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide CAS Name: 4-[[5-amino-1-[cycloheptyl(oxo)methyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide IUPAC Name: 4-[[5-amino-1-(cycloheptanecarbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Traditional Name: 4-[[5-amino-1-(cycloheptanecarbonyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Formula: C16H22N6O3S MolecularWeight: 378.44928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N

Isomeric SMILES

C1CCCC(CC1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N

InChI

InChI=1S/C16H22N6O3S/c17-15-20-16(19-12-7-9-13(10-8-12)26(18,24)25)21-22(15)14(23)11-5-3-1-2-4-6-11/h7-11H,1-6H2,(H2,18,24,25)(H3,17,19,20,21)