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

Systemtic Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]thiophene-3-carboxamide Openeye Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]thiophene-3-carboxamide CAS Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-thiophenecarboxamide IUPAC Name: N-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]thiophene-3-carboxamide Traditional Name: N-[5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]thiophene-3-carboxamide Formula: C21H16FN3O2S MolecularWeight: 393.434043

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3=CSC=C3)C4=CC=CC=C4F

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3=CSC=C3)C4=CC=CC=C4F

InChI

InChI=1S/C21H16FN3O2S/c1-25-17-9-5-3-7-15(17)18(14-6-2-4-8-16(14)22)23-19(21(25)27)24-20(26)13-10-11-28-12-13/h2-12,19H,1H3,(H,24,26)