2-azanyl-5-[bis(azanyl)methylideneamino]-N-[2-methyl-5-(phenylsulfonylamino)phenyl]pentanamide

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]-N-[2-methyl-5-(phenylsulfonylamino)phenyl]pentanamide Openeye Name: 2-amino-N-[5-(benzenesulfonamido)-2-methyl-phenyl]-5-guanidino-pentanamide CAS Name: 2-amino-N-[5-(benzenesulfonamido)-2-methylphenyl]-5-(diaminomethylideneamino)pentanamide IUPAC Name: 2-amino-N-[5-(benzenesulfonamido)-2-methylphenyl]-5-(diaminomethylideneamino)pentanamide Traditional Name: 2-amino-N-[5-(benzenesulfonamido)-2-methyl-phenyl]-5-guanidino-valeramide Formula: C19H26N6O3S MolecularWeight: 418.51314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)C(CCCN=C(N)N)N

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC=C2)NC(=O)C(CCCN=C(N)N)N

InChI

InChI=1S/C19H26N6O3S/c1-13-9-10-14(25-29(27,28)15-6-3-2-4-7-15)12-17(13)24-18(26)16(20)8-5-11-23-19(21)22/h2-4,6-7,9-10,12,16,25H,5,8,11,20H2,1H3,(H,24,26)(H4,21,22,23)