N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethoxyphenyl)carbamoyl-prop-2-enyl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethoxyphenyl)carbamoyl-prop-2-enyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[allyl-[(3,5-dimethoxyphenyl)carbamoyl]amino]-N-(1,3-benzodioxol-5-ylmethyl)-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(3,5-dimethoxyanilino)-oxomethyl]-prop-2-enylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethoxyphenyl)carbamoyl-prop-2-enylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[allyl-[(3,5-dimethoxyphenyl)carbamoyl]amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C27H29N3O6S MolecularWeight: 523.60066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)N(CC=C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)N(CC=C)CC(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=CC=CS4)OC

InChI

InChI=1S/C27H29N3O6S/c1-4-9-29(27(32)28-20-12-21(33-2)14-22(13-20)34-3)17-26(31)30(16-23-6-5-10-37-23)15-19-7-8-24-25(11-19)36-18-35-24/h4-8,10-14H,1,9,15-18H2,2-3H3,(H,28,32)