4-(2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoyl)-N'-(1H-indol-2-ylmethyl)piperazine-1-carboximidamide

Systemtic Name: 4-(2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoyl)-N'-(1H-indol-2-ylmethyl)piperazine-1-carboximidamide Openeye Name: 4-(2-cyclopentyl-2-hydroxy-2-phenyl-acetyl)-N'-(1H-indol-2-ylmethyl)piperazine-1-carboxamidine CAS Name: 4-(2-cyclopentyl-2-hydroxy-1-oxo-2-phenylethyl)-N'-(1H-indol-2-ylmethyl)-1-piperazinecarboximidamide IUPAC Name: 4-(2-cyclopentyl-2-hydroxy-2-phenylacetyl)-N'-(1H-indol-2-ylmethyl)piperazine-1-carboximidamide Traditional Name: 4-(2-cyclopentyl-2-hydroxy-2-phenyl-acetyl)-N'-(1H-indol-2-ylmethyl)piperazine-1-carboxamidine Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)N3CCN(CC3)C(=NCC4=CC5=CC=CC=C5N4)N)O

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)N3CCN(CC3)C(=NCC4=CC5=CC=CC=C5N4)N)O

InChI

InChI=1S/C27H33N5O2/c28-26(29-19-23-18-20-8-4-7-13-24(20)30-23)32-16-14-31(15-17-32)25(33)27(34,22-11-5-6-12-22)21-9-2-1-3-10-21/h1-4,7-10,13,18,22,30,34H,5-6,11-12,14-17,19H2,(H2,28,29)