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

Systemtic Name: 1-(2-chloroethyl)-3-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]urea Openeye Name: 1-(2-chloroethyl)-3-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]urea CAS Name: 1-(2-chloroethyl)-3-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]urea IUPAC Name: 1-(2-chloroethyl)-3-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]urea Traditional Name: 1-(2-chloroethyl)-3-[5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-7-yl]urea Formula: C19H18ClFN4O2 MolecularWeight: 388.823223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClFN4O2/c1-25-16-7-6-12(24-19(27)22-9-8-20)10-14(16)18(23-11-17(25)26)13-4-2-3-5-15(13)21/h2-7,10H,8-9,11H2,1H3,(H2,22,24,27)