N-(6-butyl-1,3-benzothiazol-2-yl)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carboxamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]isonipecotamide Formula: C22H29N5O3S2 MolecularWeight: 475.62736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(NN=C4C)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(NN=C4C)C

InChI

InChI=1S/C22H29N5O3S2/c1-4-5-6-16-7-8-18-19(13-16)31-22(23-18)24-21(28)17-9-11-27(12-10-17)32(29,30)20-14(2)25-26-15(20)3/h7-8,13,17H,4-6,9-12H2,1-3H3,(H,25,26)(H,23,24,28)