(2S)-3-(3-carbamimidoylphenyl)-N-methyl-2-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: (2S)-3-(3-carbamimidoylphenyl)-N-methyl-2-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: (2S)-3-(3-carbamimidoylphenyl)-N-methyl-2-(p-tolylsulfonylamino)propanamide CAS Name: (2S)-3-(3-carbamimidoylphenyl)-N-methyl-2-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: (2S)-3-(3-carbamimidoylphenyl)-N-methyl-2-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: (2S)-3-(3-amidinophenyl)-N-methyl-2-(tosylamino)propionamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC(=C2)C(=N)N)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=CC(=C2)C(=N)N)C(=O)NC

InChI

InChI=1S/C18H22N4O3S/c1-12-6-8-15(9-7-12)26(24,25)22-16(18(23)21-2)11-13-4-3-5-14(10-13)17(19)20/h3-10,16,22H,11H2,1-2H3,(H3,19,20)(H,21,23)/t16-/m0/s1