methyl (2S)-2-azanyl-5-[[azanyl-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoate

Systemtic Name: methyl (2S)-2-azanyl-5-[[azanyl-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoate Openeye Name: methyl (2S)-2-amino-5-[[amino-(p-tolylsulfonylamino)methylene]amino]pentanoate CAS Name: (2S)-2-amino-5-[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-5-[[amino-[(4-methylphenyl)sulfonylamino]methylidene]amino]pentanoate Traditional Name: (2S)-2-amino-5-[[amino-(tosylamino)methylene]amino]valeric acid methyl ester Formula: C14H22N4O4S MolecularWeight: 342.41388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCCC(C(=O)OC)N)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCC[C@@H](C(=O)OC)N)N

InChI

InChI=1S/C14H22N4O4S/c1-10-5-7-11(8-6-10)23(20,21)18-14(16)17-9-3-4-12(15)13(19)22-2/h5-8,12H,3-4,9,15H2,1-2H3,(H3,16,17,18)/t12-/m0/s1