2-[(4-carbamimidoylphenyl)amino]-2-(3-ethylsulfinylphenyl)ethanoate hydrochloride

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(3-ethylsulfinylphenyl)ethanoate hydrochloride Openeye Name: 2-(4-carbamimidoylanilino)-2-(3-ethylsulfinylphenyl)acetate hydrochloride CAS Name: 2-(4-carbamimidoylanilino)-2-(3-ethylsulfinylphenyl)acetate hydrochloride IUPAC Name: 2-(4-carbamimidoylanilino)-2-(3-ethylsulfinylphenyl)acetate hydrochloride Traditional Name: 2-(4-amidinoanilino)-2-(3-ethylsulfinylphenyl)acetate hydrochloride Formula: C17H19ClN3O3S- MolecularWeight: 380.86906

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC=CC(=C1)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N.Cl

Isomeric SMILES

CCS(=O)C1=CC=CC(=C1)C(C(=O)[O-])NC2=CC=C(C=C2)C(=N)N.Cl

InChI

InChI=1S/C17H19N3O3S.ClH/c1-2-24(23)14-5-3-4-12(10-14)15(17(21)22)20-13-8-6-11(7-9-13)16(18)19;/h3-10,15,20H,2H2,1H3,(H3,18,19)(H,21,22);1H/p-1