4-(2,5-dimethylphenyl)-N'-(phenylmethyl)sulfonyl-piperazine-1-carboximidamide

Systemtic Name: 4-(2,5-dimethylphenyl)-N'-(phenylmethyl)sulfonyl-piperazine-1-carboximidamide Openeye Name: N'-benzylsulfonyl-4-(2,5-dimethylphenyl)piperazine-1-carboxamidine CAS Name: 4-(2,5-dimethylphenyl)-N'-(phenylmethyl)sulfonyl-1-piperazinecarboximidamide IUPAC Name: N'-benzylsulfonyl-4-(2,5-dimethylphenyl)piperazine-1-carboximidamide Traditional Name: N'-benzylsulfonyl-4-(2,5-dimethylphenyl)piperazine-1-carboxamidine Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=NS(=O)(=O)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)/C(=N/S(=O)(=O)CC3=CC=CC=C3)/N

InChI

InChI=1S/C20H26N4O2S/c1-16-8-9-17(2)19(14-16)23-10-12-24(13-11-23)20(21)22-27(25,26)15-18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3,(H2,21,22)