N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-isopropylphenyl)-(2-thienyl)methyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[p-cumenyl(2-thienyl)methyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H29N3O3S2/c1-18(2)19-7-9-20(10-8-19)24(23-6-4-16-32-23)27-25(29)21-11-14-28(15-12-21)33(30,31)22-5-3-13-26-17-22/h3-10,13,16-18,21,24H,11-12,14-15H2,1-2H3,(H,27,29)