N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)benzothiophene-2-carboxamide Formula: C23H15ClN2O3S2 MolecularWeight: 466.9598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H15ClN2O3S2/c1-12-15(10-25)23(26-22(27)21-20(24)14-4-2-3-5-18(14)30-21)31-19(12)9-13-6-7-16-17(8-13)29-11-28-16/h2-8H,9,11H2,1H3,(H,26,27)