(2R)-2-[1,3-benzodioxol-5-yl(2-thiophen-2-ylethanoyl)amino]-N-cyclohexyl-2-(1-methylpyrrol-2-yl)ethanamide

Systemtic Name: (2R)-2-[1,3-benzodioxol-5-yl(2-thiophen-2-ylethanoyl)amino]-N-cyclohexyl-2-(1-methylpyrrol-2-yl)ethanamide Openeye Name: (2R)-2-[1,3-benzodioxol-5-yl-[2-(2-thienyl)acetyl]amino]-N-cyclohexyl-2-(1-methylpyrrol-2-yl)acetamide CAS Name: (2R)-2-[1,3-benzodioxol-5-yl-(1-oxo-2-thiophen-2-ylethyl)amino]-N-cyclohexyl-2-(1-methyl-2-pyrrolyl)acetamide IUPAC Name: (2R)-2-[1,3-benzodioxol-5-yl-(2-thiophen-2-ylacetyl)amino]-N-cyclohexyl-2-(1-methylpyrrol-2-yl)acetamide Traditional Name: (2R)-2-[1,3-benzodioxol-5-yl-[2-(2-thienyl)acetyl]amino]-N-cyclohexyl-2-(1-methylpyrrol-2-yl)acetamide Formula: C26H29N3O4S MolecularWeight: 479.59116

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(C(=O)NC2CCCCC2)N(C3=CC4=C(C=C3)OCO4)C(=O)CC5=CC=CS5

Isomeric SMILES

CN1C=CC=C1[C@H](C(=O)NC2CCCCC2)N(C3=CC4=C(C=C3)OCO4)C(=O)CC5=CC=CS5

InChI

InChI=1S/C26H29N3O4S/c1-28-13-5-10-21(28)25(26(31)27-18-7-3-2-4-8-18)29(24(30)16-20-9-6-14-34-20)19-11-12-22-23(15-19)33-17-32-22/h5-6,9-15,18,25H,2-4,7-8,16-17H2,1H3,(H,27,31)/t25-/m1/s1