N-[1-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylpiperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)-4-piperidyl]thiophene-2-sulfonamide Formula: C21H23ClN4O3S2 MolecularWeight: 479.01532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H23ClN4O3S2/c1-15-19(20(22)26(23-15)14-16-6-3-2-4-7-16)21(27)25-11-9-17(10-12-25)24-31(28,29)18-8-5-13-30-18/h2-8,13,17,24H,9-12,14H2,1H3