1-[2,4-bis(oxidanylidene)-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-phenyl-1,5-benzodiazepin-3-yl]-3-phenyl-urea

Systemtic Name: 1-[2,4-bis(oxidanylidene)-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-phenyl-1,5-benzodiazepin-3-yl]-3-phenyl-urea Openeye Name: 1-[2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-5-phenyl-1,5-benzodiazepin-3-yl]-3-phenyl-urea CAS Name: 1-[2,4-dioxo-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5-phenyl-1,5-benzodiazepin-3-yl]-3-phenylurea IUPAC Name: 1-[2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenyl-1,5-benzodiazepin-3-yl]-3-phenylurea Traditional Name: 1-[2,4-diketo-1-(2-keto-2-pyrrolidino-ethyl)-5-phenyl-1,5-benzodiazepin-3-yl]-3-phenyl-urea Formula: C28H27N5O4 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C3=CC=CC=C3N(C(=O)C(C2=O)NC(=O)NC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)CN2C3=CC=CC=C3N(C(=O)C(C2=O)NC(=O)NC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27N5O4/c34-24(31-17-9-10-18-31)19-32-22-15-7-8-16-23(22)33(21-13-5-2-6-14-21)27(36)25(26(32)35)30-28(37)29-20-11-3-1-4-12-20/h1-8,11-16,25H,9-10,17-19H2,(H2,29,30,37)