1-(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(dimethylamino)naphthalen-1-yl]urea

Systemtic Name: 1-(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(dimethylamino)naphthalen-1-yl]urea Openeye Name: 1-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(dimethylamino)-1-naphthyl]urea CAS Name: 1-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(dimethylamino)-1-naphthalenyl]urea IUPAC Name: 1-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(dimethylamino)naphthalen-1-yl]urea Traditional Name: 1-(7-chloro-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(dimethylamino)-1-naphthyl]urea Formula: C29H26ClN5O2 MolecularWeight: 512.00204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)NC(=O)NC3=CC=C(C4=CC=CC=C43)N(C)C)C5=CC=CC=C5

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)NC(=O)NC3=CC=C(C4=CC=CC=C43)N(C)C)C5=CC=CC=C5

InChI

InChI=1S/C29H26ClN5O2/c1-34(2)24-16-14-23(20-11-7-8-12-21(20)24)31-29(37)33-27-28(36)35(3)25-15-13-19(30)17-22(25)26(32-27)18-9-5-4-6-10-18/h4-17,27H,1-3H3,(H2,31,33,37)