4-[[4-(4-ethenylphenyl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[4-(4-ethenylphenyl)sulfonyl-2-oxidanylidene-piperazin-1-yl]methyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[2-oxo-4-(4-vinylphenyl)sulfonyl-piperazin-1-yl]methyl]benzamidine hydrochloride CAS Name: 4-[[4-(4-ethenylphenyl)sulfonyl-2-oxo-1-piperazinyl]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[4-(4-ethenylphenyl)sulfonyl-2-oxopiperazin-1-yl]methyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[2-keto-4-(4-vinylphenyl)sulfonyl-piperazino]methyl]benzamidine hydrochloride Formula: C20H23ClN4O3S MolecularWeight: 434.93962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)C(=N)N.Cl

Isomeric SMILES

C=CC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)C(=N)N.Cl

InChI

InChI=1S/C20H22N4O3S.ClH/c1-2-15-5-9-18(10-6-15)28(26,27)24-12-11-23(19(25)14-24)13-16-3-7-17(8-4-16)20(21)22;/h2-10H,1,11-14H2,(H3,21,22);1H