N-(2-methyl-6-propan-2-yl-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-6-propan-2-ylphenyl)-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2CCN(CC2)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C25H34N2O3S/c1-19(2)23-13-7-9-20(3)24(23)26-25(28)22-14-16-27(17-15-22)31(29,30)18-8-12-21-10-5-4-6-11-21/h4-7,9-11,13,19,22H,8,12,14-18H2,1-3H3,(H,26,28)