N-[1,3-bis(chloranyl)propan-2-ylideneamino]-7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-amine

Systemtic Name: N-[1,3-bis(chloranyl)propan-2-ylideneamino]-7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-chloro-N-[[2-chloro-1-(chloromethyl)ethylidene]amino]-5-phenyl-3H-1,4-benzodiazepin-2-amine CAS Name: 7-chloro-N-(1,3-dichloropropan-2-ylideneamino)-5-phenyl-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-chloro-N-(1,3-dichloropropan-2-ylideneamino)-5-phenyl-3H-1,4-benzodiazepin-2-amine Traditional Name: [[2-chloro-1-(chloromethyl)ethylidene]amino]-(7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amine Formula: C18H15Cl3N4 MolecularWeight: 393.6975

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)NN=C(CCl)CCl

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)NN=C(CCl)CCl

InChI

InChI=1S/C18H15Cl3N4/c19-9-14(10-20)24-25-17-11-22-18(12-4-2-1-3-5-12)15-8-13(21)6-7-16(15)23-17/h1-8H,9-11H2,(H,23,25)