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

Systemtic Name: 1-[1-butyl-2,4-bis(oxidanylidene)-5-phenyl-1,5-benzodiazepin-3-yl]-3-phenyl-urea Openeye Name: 1-(1-butyl-2,4-dioxo-5-phenyl-1,5-benzodiazepin-3-yl)-3-phenyl-urea CAS Name: 1-(1-butyl-2,4-dioxo-5-phenyl-1,5-benzodiazepin-3-yl)-3-phenylurea IUPAC Name: 1-(1-butyl-2,4-dioxo-5-phenyl-1,5-benzodiazepin-3-yl)-3-phenylurea Traditional Name: 1-(1-butyl-2,4-diketo-5-phenyl-1,5-benzodiazepin-3-yl)-3-phenyl-urea Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N(C(=O)C(C1=O)NC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C2=CC=CC=C2N(C(=O)C(C1=O)NC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O3/c1-2-3-18-29-21-16-10-11-17-22(21)30(20-14-8-5-9-15-20)25(32)23(24(29)31)28-26(33)27-19-12-6-4-7-13-19/h4-17,23H,2-3,18H2,1H3,(H2,27,28,33)