3-azanyl-5-(2-fluorophenyl)-1-(thiophen-3-ylmethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-5-(2-fluorophenyl)-1-(thiophen-3-ylmethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-5-(2-fluorophenyl)-1-(3-thienylmethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-5-(2-fluorophenyl)-1-(3-thiophenylmethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-5-(2-fluorophenyl)-1-(thiophen-3-ylmethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-5-(2-fluorophenyl)-1-(3-thenyl)-3H-1,4-benzodiazepin-2-one Formula: C20H16FN3OS MolecularWeight: 365.423943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(C(=O)N2CC3=CSC=C3)N)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(C(=O)N2CC3=CSC=C3)N)C4=CC=CC=C4F

InChI

InChI=1S/C20H16FN3OS/c21-16-7-3-1-5-14(16)18-15-6-2-4-8-17(15)24(20(25)19(22)23-18)11-13-9-10-26-12-13/h1-10,12,19H,11,22H2