4-[2-[2-(4-azanyl-4-cyanoimino-butyl)phenyl]sulfanylphenyl]-N'-cyano-butanimidamide

Systemtic Name: 4-[2-[2-(4-azanyl-4-cyanoimino-butyl)phenyl]sulfanylphenyl]-N'-cyano-butanimidamide Openeye Name: 4-[2-[2-(4-amino-4-cyanoimino-butyl)phenyl]sulfanylphenyl]-N'-cyano-butanamidine CAS Name: 4-[2-[[2-(4-amino-4-cyanoiminobutyl)phenyl]thio]phenyl]-N'-cyanobutanimidamide IUPAC Name: 4-[2-[2-(4-amino-4-cyanoiminobutyl)phenyl]sulfanylphenyl]-N'-cyanobutanimidamide Traditional Name: 4-[2-[[2-(4-amino-4-cyanoimino-butyl)phenyl]thio]phenyl]-N'-cyano-butyramidine Formula: C22H24N6S MolecularWeight: 404.53116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCC(=NC#N)N)SC2=CC=CC=C2CCCC(=NC#N)N

Isomeric SMILES

C1=CC=C(C(=C1)CCCC(=NC#N)N)SC2=CC=CC=C2CCCC(=NC#N)N

InChI

InChI=1S/C22H24N6S/c23-15-27-21(25)13-5-9-17-7-1-3-11-19(17)29-20-12-4-2-8-18(20)10-6-14-22(26)28-16-24/h1-4,7-8,11-12H,5-6,9-10,13-14H2,(H2,25,27)(H2,26,28)