N-[[4-[2-(1,3-benzodioxol-5-yl)ethylcarbamoyl]phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-[2-(1,3-benzodioxol-5-yl)ethylcarbamoyl]phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-[[4-[2-(1,3-benzodioxol-5-yl)ethylcarbamoyl]phenyl]methyl]thiophene-2-carboxamide CAS Name: N-[[4-[[2-(1,3-benzodioxol-5-yl)ethylamino]-oxomethyl]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-[2-(1,3-benzodioxol-5-yl)ethylcarbamoyl]phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-[4-(homopiperonylcarbamoyl)benzyl]thiophene-2-carboxamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H20N2O4S/c25-21(23-10-9-15-5-8-18-19(12-15)28-14-27-18)17-6-3-16(4-7-17)13-24-22(26)20-2-1-11-29-20/h1-8,11-12H,9-10,13-14H2,(H,23,25)(H,24,26)