1-tert-butyl-3-(2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea

Systemtic Name: 1-tert-butyl-3-(2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Openeye Name: 1-tert-butyl-3-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea CAS Name: 1-tert-butyl-3-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea IUPAC Name: 1-tert-butyl-3-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Traditional Name: 1-tert-butyl-3-(2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1C(=O)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)NC1C(=O)NC2=CC=CC=C2C(=N1)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2/c1-20(2,3)24-19(26)23-17-18(25)21-15-12-8-7-11-14(15)16(22-17)13-9-5-4-6-10-13/h4-12,17H,1-3H3,(H,21,25)(H2,23,24,26)