5-[bis(azanyl)methylideneamino]-2-[(4-methylphenyl)sulfonylamino]pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[(4-methylphenyl)sulfonylamino]pentanamide Openeye Name: 5-guanidino-2-(p-tolylsulfonylamino)pentanamide CAS Name: 5-(diaminomethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanamide IUPAC Name: 5-(diaminomethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanamide Traditional Name: 5-guanidino-2-(tosylamino)valeramide Formula: C13H21N5O3S MolecularWeight: 327.40254

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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)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCN=C(N)N)C(=O)N

InChI

InChI=1S/C13H21N5O3S/c1-9-4-6-10(7-5-9)22(20,21)18-11(12(14)19)3-2-8-17-13(15)16/h4-7,11,18H,2-3,8H2,1H3,(H2,14,19)(H4,15,16,17)