1-[(3R)-3-(4-chlorophenyl)-2-methyl-3H-1,5-benzodiazepin-4-yl]-3-ethyl-urea

Systemtic Name: 1-[(3R)-3-(4-chlorophenyl)-2-methyl-3H-1,5-benzodiazepin-4-yl]-3-ethyl-urea Openeye Name: 1-[(3R)-3-(4-chlorophenyl)-2-methyl-3H-1,5-benzodiazepin-4-yl]-3-ethyl-urea CAS Name: 1-[(3R)-3-(4-chlorophenyl)-2-methyl-3H-1,5-benzodiazepin-4-yl]-3-ethylurea IUPAC Name: 1-[(3R)-3-(4-chlorophenyl)-2-methyl-3H-1,5-benzodiazepin-4-yl]-3-ethylurea Traditional Name: 1-[(3R)-3-(4-chlorophenyl)-2-methyl-3H-1,5-benzodiazepin-4-yl]-3-ethyl-urea Formula: C19H19ClN4O MolecularWeight: 354.83336

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=CC=CC=C2N=C(C1C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCNC(=O)NC1=NC2=CC=CC=C2N=C([C@H]1C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C19H19ClN4O/c1-3-21-19(25)24-18-17(13-8-10-14(20)11-9-13)12(2)22-15-6-4-5-7-16(15)23-18/h4-11,17H,3H2,1-2H3,(H2,21,23,24,25)/t17-/m0/s1