1-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]-3-(3-oxidanylpropyl)urea

Systemtic Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]-3-(3-oxidanylpropyl)urea Openeye Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]-3-(3-hydroxypropyl)urea CAS Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]-3-(3-hydroxypropyl)urea IUPAC Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]-3-(3-hydroxypropyl)urea Traditional Name: 1-[5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-7-yl]-3-(3-hydroxypropyl)urea Formula: C20H21FN4O3 MolecularWeight: 384.404143

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C1C=CC(=C2)NC(=O)NCCCO)C3=CC=CC=C3F

Isomeric SMILES

CN1C(=O)CN=C(C2=C1C=CC(=C2)NC(=O)NCCCO)C3=CC=CC=C3F

InChI

InChI=1S/C20H21FN4O3/c1-25-17-8-7-13(24-20(28)22-9-4-10-26)11-15(17)19(23-12-18(25)27)14-5-2-3-6-16(14)21/h2-3,5-8,11,26H,4,9-10,12H2,1H3,(H2,22,24,28)