N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexylcarbamoyl(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexylcarbamoyl(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexylcarbamoyl(3-methoxypropyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(cyclohexylamino)-oxomethyl]-(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclohexylcarbamoyl(3-methoxypropyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[cyclohexylcarbamoyl(3-methoxypropyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C26H35N3O5S MolecularWeight: 501.6382

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)NC4CCCCC4

Isomeric SMILES

COCCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)C(=O)NC4CCCCC4

InChI

InChI=1S/C26H35N3O5S/c1-32-13-6-12-28(26(31)27-21-7-3-2-4-8-21)18-25(30)29(17-22-9-5-14-35-22)16-20-10-11-23-24(15-20)34-19-33-23/h5,9-11,14-15,21H,2-4,6-8,12-13,16-19H2,1H3,(H,27,31)