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4-[3-[4-(4-methylphenyl)sulfonylphenyl]prop-2-ynylamino]benzenecarboximidamide

4-[3-[4-(4-methylphenyl)sulfonylphenyl]prop-2-ynylamino]benzenecarboximidamide

Systemtic Name:4-[3-[4-(4-methylphenyl)sulfonylphenyl]prop-2-ynylamino]benzenecarboximidamide
Openeye Name:4-[3-[4-(p-tolylsulfonyl)phenyl]prop-2-ynylamino]benzamidine
CAS Name:4-[3-[4-(4-methylphenyl)sulfonylphenyl]prop-2-ynylamino]benzenecarboximidamide
IUPAC Name:4-[3-[4-(4-methylphenyl)sulfonylphenyl]prop-2-ynylamino]benzenecarboximidamide
Traditional Name:4-[3-(4-tosylphenyl)prop-2-ynylamino]benzamidine
Formula: C23H21N3O2S
MolecularWeight: 403.49674
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C#CCNC3=CC=C(C=C3)C(=N)N


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C#CCNC3=CC=C(C=C3)C(=N)N


InChI

InChI=1S/C23H21N3O2S/c1-17-4-12-21(13-5-17)29(27,28)22-14-6-18(7-15-22)3-2-16-26-20-10-8-19(9-11-20)23(24)25/h4-15,26H,16H2,1H3,(H3,24,25)


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