N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl-(4-methoxyphenyl)sulfonyl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl-(4-methoxyphenyl)sulfonyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl-(4-methoxyphenyl)sulfonyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl-(4-methoxyphenyl)sulfonylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[cyclopropyl-(4-methoxyphenyl)sulfonylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[cyclopropyl-(4-methoxyphenyl)sulfonyl-amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C25H26N2O6S2 MolecularWeight: 514.61374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C5CC5

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C5CC5

InChI

InChI=1S/C25H26N2O6S2/c1-31-20-7-9-22(10-8-20)35(29,30)27(19-5-6-19)16-25(28)26(15-21-3-2-12-34-21)14-18-4-11-23-24(13-18)33-17-32-23/h2-4,7-13,19H,5-6,14-17H2,1H3