N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)sulfonyl-propan-2-yl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)sulfonyl-propan-2-yl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[isopropyl(p-tolylsulfonyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)sulfonyl-propan-2-ylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methylphenyl)sulfonyl-propan-2-ylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[isopropyl(tosyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C25H28N2O5S2 MolecularWeight: 500.63022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)C(C)C

InChI

InChI=1S/C25H28N2O5S2/c1-18(2)27(34(29,30)22-9-6-19(3)7-10-22)16-25(28)26(15-21-5-4-12-33-21)14-20-8-11-23-24(13-20)32-17-31-23/h4-13,18H,14-17H2,1-3H3