2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetamide Formula: C19H19ClN2O4S MolecularWeight: 406.88316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CN(CC=C)CC3=CC=C(S3)Cl)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CN(CC=C)CC3=CC=C(S3)Cl)OCO2

InChI

InChI=1S/C19H19ClN2O4S/c1-3-6-22(9-13-4-5-18(20)27-13)10-19(24)21-15-8-17-16(25-11-26-17)7-14(15)12(2)23/h3-5,7-8H,1,6,9-11H2,2H3,(H,21,24)