2-azanyl-5-[bis(azanyl)methylideneamino]-N-tert-butyl-N-[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-ethyl]pentanamide

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]-N-tert-butyl-N-[1-(4-methylphenyl)sulfonyl-2-oxidanylidene-ethyl]pentanamide Openeye Name: 2-amino-N-tert-butyl-5-guanidino-N-[2-oxo-1-(p-tolylsulfonyl)ethyl]pentanamide CAS Name: 2-amino-N-tert-butyl-5-(diaminomethylideneamino)-N-[1-(4-methylphenyl)sulfonyl-2-oxoethyl]pentanamide IUPAC Name: 2-amino-N-tert-butyl-5-(diaminomethylideneamino)-N-[1-(4-methylphenyl)sulfonyl-2-oxoethyl]pentanamide Traditional Name: 2-amino-N-tert-butyl-5-guanidino-N-(2-keto-1-tosyl-ethyl)valeramide Formula: C19H31N5O4S MolecularWeight: 425.54554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31N5O4S/c1-13-7-9-14(10-8-13)29(27,28)16(12-25)24(19(2,3)4)17(26)15(20)6-5-11-23-18(21)22/h7-10,12,15-16H,5-6,11,20H2,1-4H3,(H4,21,22,23)