methyl (2R)-5-[bis(azanyl)methylideneamino]-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: methyl (2R)-5-[bis(azanyl)methylideneamino]-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: methyl (2R)-5-guanidino-2-(p-tolylsulfonylamino)pentanoate CAS Name: (2R)-5-(diaminomethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoic acid methyl ester IUPAC Name: methyl (2R)-5-(diaminomethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: (2R)-5-guanidino-2-(tosylamino)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(CCCN=C(N)N)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O4S/c1-10-5-7-11(8-6-10)23(20,21)18-12(13(19)22-2)4-3-9-17-14(15)16/h5-8,12,18H,3-4,9H2,1-2H3,(H4,15,16,17)/t12-/m1/s1