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

Systemtic Name: 1-[1-(2-cyclopentyl-2-oxidanylidene-ethyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-pyridin-3-yl-urea Openeye Name: 1-[1-(2-cyclopentyl-2-oxo-ethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-pyridyl)urea CAS Name: 1-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-pyridinyl)urea IUPAC Name: 1-[1-(2-cyclopentyl-2-oxoethyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-pyridin-3-ylurea Traditional Name: 1-[1-(2-cyclopentyl-2-keto-ethyl)-2-keto-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-pyridyl)urea Formula: C28H27N5O3 MolecularWeight: 481.54568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27N5O3/c34-24(19-9-4-5-10-19)18-33-23-15-7-6-14-22(23)25(20-11-2-1-3-12-20)31-26(27(33)35)32-28(36)30-21-13-8-16-29-17-21/h1-3,6-8,11-17,19,26H,4-5,9-10,18H2,(H2,30,32,36)