N,N-dimethyl-3-[1-[(4-methylphenyl)methyl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide

Systemtic Name: N,N-dimethyl-3-[1-[(4-methylphenyl)methyl]-5-oxidanylidene-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide Openeye Name: N,N-dimethyl-3-[5-oxo-1-(p-tolylmethyl)-4-(2-thienyl)-1,2,4-triazol-3-yl]piperidine-1-sulfonamide CAS Name: N,N-dimethyl-3-[1-[(4-methylphenyl)methyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-3-yl]-1-piperidinesulfonamide IUPAC Name: N,N-dimethyl-3-[1-[(4-methylphenyl)methyl]-5-oxo-4-thiophen-2-yl-1,2,4-triazol-3-yl]piperidine-1-sulfonamide Traditional Name: 3-[5-keto-1-(4-methylbenzyl)-4-(2-thienyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-piperidine-1-sulfonamide Formula: C21H27N5O3S2 MolecularWeight: 461.60078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)N(C(=N2)C3CCCN(C3)S(=O)(=O)N(C)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)N(C(=N2)C3CCCN(C3)S(=O)(=O)N(C)C)C4=CC=CS4

InChI

InChI=1S/C21H27N5O3S2/c1-16-8-10-17(11-9-16)14-25-21(27)26(19-7-5-13-30-19)20(22-25)18-6-4-12-24(15-18)31(28,29)23(2)3/h5,7-11,13,18H,4,6,12,14-15H2,1-3H3