N-(3-indol-1-ylpropyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-indol-1-ylpropyl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-indol-1-ylpropyl)-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(1-indolyl)propyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-indol-1-ylpropyl)-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-indol-1-ylpropyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C25H29N3O3S MolecularWeight: 451.58106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCN2C=CC3=CC=CC=C32)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NCCCN2C=CC3=CC=CC=C32)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O3S/c29-25(26-15-6-16-27-17-11-22-9-4-5-10-24(22)27)23-12-18-28(19-13-23)32(30,31)20-14-21-7-2-1-3-8-21/h1-5,7-11,14,17,20,23H,6,12-13,15-16,18-19H2,(H,26,29)/b20-14+