N-[2-[1,3-benzodioxol-5-ylmethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-propanamide

Systemtic Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-N-[2-[1,3-benzodioxol-5-ylmethyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]propanamide CAS Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]-N-prop-2-enylpropanamide IUPAC Name: N-[2-[1,3-benzodioxol-5-ylmethyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-prop-2-enylpropanamide Traditional Name: N-allyl-N-[2-keto-2-[(3-methyl-2-thienyl)methyl-piperonyl-amino]ethyl]propionamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4S/c1-4-9-23(21(25)5-2)14-22(26)24(13-20-16(3)8-10-29-20)12-17-6-7-18-19(11-17)28-15-27-18/h4,6-8,10-11H,1,5,9,12-15H2,2-3H3