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

Systemtic Name: 1,1-diethyl-3-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]urea Openeye Name: 1,1-diethyl-3-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]urea CAS Name: 1,1-diethyl-3-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]urea IUPAC Name: 1,1-diethyl-3-[5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]urea Traditional Name: 1,1-diethyl-3-[5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-7-yl]urea Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)NC1=CC2=C(C=C1)N(C(=O)CN=C2C3=CC=CC=C3F)C

Isomeric SMILES

CCN(CC)C(=O)NC1=CC2=C(C=C1)N(C(=O)CN=C2C3=CC=CC=C3F)C

InChI

InChI=1S/C21H23FN4O2/c1-4-26(5-2)21(28)24-14-10-11-18-16(12-14)20(23-13-19(27)25(18)3)15-8-6-7-9-17(15)22/h6-12H,4-5,13H2,1-3H3,(H,24,28)