N-(3-methylbutanoylamino)-N'-(4-methylphenyl)sulfonyl-benzenecarboximidamide

Systemtic Name: N-(3-methylbutanoylamino)-N'-(4-methylphenyl)sulfonyl-benzenecarboximidamide Openeye Name: N-(3-methylbutanoylamino)-N'-(p-tolylsulfonyl)benzamidine CAS Name: N-[(3-methyl-1-oxobutyl)amino]-N'-(4-methylphenyl)sulfonylbenzenecarboximidamide IUPAC Name: N-(3-methylbutanoylamino)-N'-(4-methylphenyl)sulfonylbenzenecarboximidamide Traditional Name: N-(isovalerylamino)-N'-tosyl-benzamidine Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(C2=CC=CC=C2)NNC(=O)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=C(C2=CC=CC=C2)NNC(=O)CC(C)C

InChI

InChI=1S/C19H23N3O3S/c1-14(2)13-18(23)20-21-19(16-7-5-4-6-8-16)22-26(24,25)17-11-9-15(3)10-12-17/h4-12,14H,13H2,1-3H3,(H,20,23)(H,21,22)