N1,N1-bis(2-chloroethyl)-4-(4-methylpiperazin-1-yl)sulfonyl-benzene-1,2-diamine

Systemtic Name: N1,N1-bis(2-chloroethyl)-4-(4-methylpiperazin-1-yl)sulfonyl-benzene-1,2-diamine Openeye Name: N1,N1-bis(2-chloroethyl)-4-(4-methylpiperazin-1-yl)sulfonyl-benzene-1,2-diamine CAS Name: N1,N1-bis(2-chloroethyl)-4-[(4-methyl-1-piperazinyl)sulfonyl]benzene-1,2-diamine IUPAC Name: 1-N,1-N-bis(2-chloroethyl)-4-(4-methylpiperazin-1-yl)sulfonylbenzene-1,2-diamine Traditional Name: [2-amino-4-(4-methylpiperazino)sulfonyl-phenyl]-bis(2-chloroethyl)amine Formula: C15H24Cl2N4O2S MolecularWeight: 395.34766

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(CCCl)CCCl)N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(CCCl)CCCl)N

InChI

InChI=1S/C15H24Cl2N4O2S/c1-19-8-10-21(11-9-19)24(22,23)13-2-3-15(14(18)12-13)20(6-4-16)7-5-17/h2-3,12H,4-11,18H2,1H3