N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)phenyl]methyl]thiophene-2-carboxamide Openeye Name: N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)phenyl]methyl]thiophene-2-carboxamide CAS Name: N-[[4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)phenyl]methyl]thiophene-2-carboxamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)benzyl]thiophene-2-carboxamide Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C21H18N2O4S/c24-20(23-16-7-8-17-18(12-16)27-10-9-26-17)15-5-3-14(4-6-15)13-22-21(25)19-2-1-11-28-19/h1-8,11-12H,9-10,13H2,(H,22,25)(H,23,24)