1-(3-chlorophenyl)-3-[1-(2-cycloheptyl-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[1-(2-cycloheptyl-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Openeye Name: 1-(3-chlorophenyl)-3-[1-(2-cycloheptyl-2-oxo-ethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea CAS Name: 1-(3-chlorophenyl)-3-[1-(2-cycloheptyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[1-(2-cycloheptyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Traditional Name: 1-(3-chlorophenyl)-3-[1-(2-cycloheptyl-2-keto-ethyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Formula: C31H31ClN4O3 MolecularWeight: 543.05584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC(=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CCCC(CC1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC(=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C31H31ClN4O3/c32-23-15-10-16-24(19-23)33-31(39)35-29-30(38)36(20-27(37)21-11-4-1-2-5-12-21)26-18-9-8-17-25(26)28(34-29)22-13-6-3-7-14-22/h3,6-10,13-19,21,29H,1-2,4-5,11-12,20H2,(H2,33,35,39)