2-[3-[[3-(dimethylamino)phenyl]carbamoylamino]-2,4-bis(oxidanylidene)-5-phenyl-1,5-benzodiazepin-1-yl]-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[3-[[3-(dimethylamino)phenyl]carbamoylamino]-2,4-bis(oxidanylidene)-5-phenyl-1,5-benzodiazepin-1-yl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-[3-[[3-(dimethylamino)phenyl]carbamoylamino]-2,4-dioxo-5-phenyl-1,5-benzodiazepin-1-yl]-N-isopropyl-N-phenyl-acetamide CAS Name: 2-[3-[[[3-(dimethylamino)anilino]-oxomethyl]amino]-2,4-dioxo-5-phenyl-1,5-benzodiazepin-1-yl]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[3-[[3-(dimethylamino)phenyl]carbamoylamino]-2,4-dioxo-5-phenyl-1,5-benzodiazepin-1-yl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: 2-[3-[[3-(dimethylamino)phenyl]carbamoylamino]-2,4-diketo-5-phenyl-1,5-benzodiazepin-1-yl]-N-isopropyl-N-phenyl-acetamide Formula: C35H36N6O4 MolecularWeight: 604.69814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H36N6O4/c1-24(2)40(26-15-7-5-8-16-26)31(42)23-39-29-20-11-12-21-30(29)41(27-17-9-6-10-18-27)34(44)32(33(39)43)37-35(45)36-25-14-13-19-28(22-25)38(3)4/h5-22,24,32H,23H2,1-4H3,(H2,36,37,45)