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

Systemtic Name: 1-(2-methylsulfanylphenyl)-3-(2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Openeye Name: 1-(2-methylsulfanylphenyl)-3-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea CAS Name: 1-[2-(methylthio)phenyl]-3-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea IUPAC Name: 1-(2-methylsulfanylphenyl)-3-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea Traditional Name: 1-(2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)-3-[2-(methylthio)phenyl]urea Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)NC2C(=O)NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)NC2C(=O)NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2S/c1-30-19-14-8-7-13-18(19)25-23(29)27-21-22(28)24-17-12-6-5-11-16(17)20(26-21)15-9-3-2-4-10-15/h2-14,21H,1H3,(H,24,28)(H2,25,27,29)