N-[4-[1,3-benzodioxol-5-ylmethyl(ethyl)carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[1,3-benzodioxol-5-ylmethyl(ethyl)carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[1,3-benzodioxol-5-ylmethyl(ethyl)carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[1,3-benzodioxol-5-ylmethyl(ethyl)carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[ethyl(piperonyl)carbamoyl]phenyl]thiophene-2-carboxamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H20N2O4S/c1-2-24(13-15-5-10-18-19(12-15)28-14-27-18)22(26)16-6-8-17(9-7-16)23-21(25)20-4-3-11-29-20/h3-12H,2,13-14H2,1H3,(H,23,25)