N-(1,3-benzodioxol-5-ylmethyl)-1-(5-indol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-indol-1-ylthiophen-2-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-indol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[[5-(1-indolyl)-2-thiophenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-indol-1-ylthiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(5-indol-1-ylthiophene-2-carbonyl)-N-piperonyl-isonipecotamide Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(S4)N5C=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(S4)N5C=CC6=CC=CC=C65

InChI

InChI=1S/C27H25N3O4S/c31-26(28-16-18-5-6-22-23(15-18)34-17-33-22)20-9-12-29(13-10-20)27(32)24-7-8-25(35-24)30-14-11-19-3-1-2-4-21(19)30/h1-8,11,14-15,20H,9-10,12-13,16-17H2,(H,28,31)