N',N'-diethyl-N-[4-(4-methylphenyl)sulfonyl-2-methylsulfonyl-1,3-thiazol-5-yl]propane-1,3-diamine

Systemtic Name: N',N'-diethyl-N-[4-(4-methylphenyl)sulfonyl-2-methylsulfonyl-1,3-thiazol-5-yl]propane-1,3-diamine Openeye Name: N',N'-diethyl-N-[2-methylsulfonyl-4-(p-tolylsulfonyl)thiazol-5-yl]propane-1,3-diamine CAS Name: N',N'-diethyl-N-[4-(4-methylphenyl)sulfonyl-2-methylsulfonyl-5-thiazolyl]propane-1,3-diamine IUPAC Name: N',N'-diethyl-N-[4-(4-methylphenyl)sulfonyl-2-methylsulfonyl-1,3-thiazol-5-yl]propane-1,3-diamine Traditional Name: diethyl-[3-[(2-mesyl-4-tosyl-thiazol-5-yl)amino]propyl]amine Formula: C18H27N3O4S3 MolecularWeight: 445.61968

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=C(N=C(S1)S(=O)(=O)C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)CCCNC1=C(N=C(S1)S(=O)(=O)C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H27N3O4S3/c1-5-21(6-2)13-7-12-19-16-17(20-18(26-16)27(4,22)23)28(24,25)15-10-8-14(3)9-11-15/h8-11,19H,5-7,12-13H2,1-4H3