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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[ethylcarbamoyl(propan-2-yl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[ethylcarbamoyl(isopropyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[ethylcarbamoyl(propan-2-yl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[ethylcarbamoyl(propan-2-yl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[ethylcarbamoyl(isopropyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c1-4-22-21(26)24(15(2)3)13-20(25)23(12-17-6-5-9-29-17)11-16-7-8-18-19(10-16)28-14-27-18/h5-10,15H,4,11-14H2,1-3H3,(H,22,26)