N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-3-yl]methyl]thiophene-3-carboxamide

Systemtic Name: N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-3-yl]methyl]thiophene-3-carboxamide Openeye Name: N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-3-yl]methyl]thiophene-3-carboxamide CAS Name: N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-3-yl]methyl]-3-thiophenecarboxamide IUPAC Name: N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-3-yl]methyl]thiophene-3-carboxamide Traditional Name: N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-3-yl]methyl]thiophene-3-carboxamide Formula: C22H20FN3OS MolecularWeight: 393.477103

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(N=C(C2=CC=CC=C21)C3=CC=CC=C3F)CNC(=O)C4=CSC=C4

Isomeric SMILES

CN1CC(N=C(C2=CC=CC=C21)C3=CC=CC=C3F)CNC(=O)C4=CSC=C4

InChI

InChI=1S/C22H20FN3OS/c1-26-13-16(12-24-22(27)15-10-11-28-14-15)25-21(17-6-2-4-8-19(17)23)18-7-3-5-9-20(18)26/h2-11,14,16H,12-13H2,1H3,(H,24,27)