N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-ethylphenyl)carbamoyl-(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-ethylphenyl)carbamoyl-(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-ethylphenyl)carbamoyl-(2-methoxyethyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(3-ethylanilino)-oxomethyl]-(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-ethylphenyl)carbamoyl-(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(3-ethylphenyl)carbamoyl-(2-methoxyethyl)amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C27H31N3O5S MolecularWeight: 509.61714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)N(CCOC)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)N(CCOC)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4

InChI

InChI=1S/C27H31N3O5S/c1-3-20-6-4-7-22(14-20)28-27(32)29(11-12-33-2)18-26(31)30(17-23-8-5-13-36-23)16-21-9-10-24-25(15-21)35-19-34-24/h4-10,13-15H,3,11-12,16-19H2,1-2H3,(H,28,32)