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

Systemtic Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3-propyl-3H-1,4-benzodiazepin-7-yl]-3-(2-hydroxyethyl)urea Openeye Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxo-3-propyl-3H-1,4-benzodiazepin-7-yl]-3-(2-hydroxyethyl)urea CAS Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxo-3-propyl-3H-1,4-benzodiazepin-7-yl]-3-(2-hydroxyethyl)urea IUPAC Name: 1-[5-(2-fluorophenyl)-1-methyl-2-oxo-3-propyl-3H-1,4-benzodiazepin-7-yl]-3-(2-hydroxyethyl)urea Traditional Name: 1-[5-(2-fluorophenyl)-2-keto-1-methyl-3-propyl-3H-1,4-benzodiazepin-7-yl]-3-(2-hydroxyethyl)urea Formula: C22H25FN4O3 MolecularWeight: 412.457303

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C2=C(C=C(C=C2)NC(=O)NCCO)C(=N1)C3=CC=CC=C3F)C

Isomeric SMILES

CCCC1C(=O)N(C2=C(C=C(C=C2)NC(=O)NCCO)C(=N1)C3=CC=CC=C3F)C

InChI

InChI=1S/C22H25FN4O3/c1-3-6-18-21(29)27(2)19-10-9-14(25-22(30)24-11-12-28)13-16(19)20(26-18)15-7-4-5-8-17(15)23/h4-5,7-10,13,18,28H,3,6,11-12H2,1-2H3,(H2,24,25,30)