N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-2-methyl-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H18FNO3S MolecularWeight: 383.435923

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=CC=CC=C2O1)C(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

CC1C(OC2=CC=CC=C2O1)C(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C21H18FNO3S/c1-13-20(26-17-6-3-2-5-16(17)25-13)21(24)23-19(18-7-4-12-27-18)14-8-10-15(22)11-9-14/h2-13,19-20H,1H3,(H,23,24)