N,N'-bis[3-[[4-[bis(2-chloroethyl)amino]-2-methyl-phenyl]methylideneamino]phenyl]methanediamine

Systemtic Name: N,N'-bis[3-[[4-[bis(2-chloroethyl)amino]-2-methyl-phenyl]methylideneamino]phenyl]methanediamine Openeye Name: N,N'-bis[3-[[4-[bis(2-chloroethyl)amino]-2-methyl-phenyl]methyleneamino]phenyl]methanediamine CAS Name: N,N'-bis[3-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]phenyl]methanediamine IUPAC Name: N,N'-bis[3-[[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]phenyl]methanediamine Traditional Name: [4-[[3-[[3-[[4-[bis(2-chloroethyl)amino]-2-methyl-benzylidene]amino]anilino]methylamino]phenyl]iminomethyl]-3-methyl-phenyl]-bis(2-chloroethyl)amine Formula: C37H42Cl4N6 MolecularWeight: 712.58158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=CC(=CC=C2)NCNC3=CC=CC(=C3)N=CC4=C(C=C(C=C4)N(CCCl)CCCl)C

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=CC(=CC=C2)NCNC3=CC=CC(=C3)N=CC4=C(C=C(C=C4)N(CCCl)CCCl)C

InChI

InChI=1S/C37H42Cl4N6/c1-28-21-36(46(17-13-38)18-14-39)11-9-30(28)25-42-32-5-3-7-34(23-32)44-27-45-35-8-4-6-33(24-35)43-26-31-10-12-37(22-29(31)2)47(19-15-40)20-16-41/h3-12,21-26,44-45H,13-20,27H2,1-2H3