1-(1-ethylindol-5-yl)sulfonyl-N-[(4-ethylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(1-ethylindol-5-yl)sulfonyl-N-[(4-ethylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(1-ethylindol-5-yl)sulfonyl-N-[(4-ethylphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-[(1-ethyl-5-indolyl)sulfonyl]-N-[(4-ethylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(1-ethylindol-5-yl)sulfonyl-N-[(4-ethylphenyl)methyl]piperidine-3-carboxamide Traditional Name: N-(4-ethylbenzyl)-1-(1-ethylindol-5-yl)sulfonyl-nipecotamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)N(C=C4)CC

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)N(C=C4)CC

InChI

InChI=1S/C25H31N3O3S/c1-3-19-7-9-20(10-8-19)17-26-25(29)22-6-5-14-28(18-22)32(30,31)23-11-12-24-21(16-23)13-15-27(24)4-2/h7-13,15-16,22H,3-6,14,17-18H2,1-2H3,(H,26,29)