N-[3-cyano-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-thiophen-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-cyano-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-thiophen-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-cyano-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-thienyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-cyano-5-[(2-methoxyanilino)-oxomethyl]-4-methyl-2-thiophenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-cyano-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophen-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-cyano-5-[(2-methoxyphenyl)carbamoyl]-4-methyl-2-thienyl]-piperonylamide Formula: C22H17N3O5S MolecularWeight: 435.45248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC=C4OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C22H17N3O5S/c1-12-14(10-23)22(25-20(26)13-7-8-17-18(9-13)30-11-29-17)31-19(12)21(27)24-15-5-3-4-6-16(15)28-2/h3-9H,11H2,1-2H3,(H,24,27)(H,25,26)