N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-4-pyrrolidin-1-ylphenyl)-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methyl-4-pyrrolidino-phenyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C25H31N3O3S MolecularWeight: 453.59694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O3S/c1-20-19-23(27-14-5-6-15-27)9-10-24(20)26-25(29)22-11-16-28(17-12-22)32(30,31)18-13-21-7-3-2-4-8-21/h2-4,7-10,13,18-19,22H,5-6,11-12,14-17H2,1H3,(H,26,29)/b18-13+