1-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 1-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine Openeye Name: 1-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine CAS Name: 1-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine IUPAC Name: 1-[4-[bis(2-chloroethyl)aminomethyl]phenyl]-6,6-dimethyl-1,3,5-triazine-2,4-diamine Traditional Name: bis(2-chloroethyl)-[4-(4,6-diamino-2,2-dimethyl-s-triazin-1-yl)benzyl]amine Formula: C16H24Cl2N6 MolecularWeight: 371.30796

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(N=C(N1C2=CC=C(C=C2)CN(CCCl)CCCl)N)N)C

Isomeric SMILES

CC1(N=C(N=C(N1C2=CC=C(C=C2)CN(CCCl)CCCl)N)N)C

InChI

InChI=1S/C16H24Cl2N6/c1-16(2)22-14(19)21-15(20)24(16)13-5-3-12(4-6-13)11-23(9-7-17)10-8-18/h3-6H,7-11H2,1-2H3,(H4,19,20,21,22)