N-[(E)-[4-(3-methylbutoxy)phenyl]methylideneamino]-N'-phenyl-1,3-benzothiazole-2-carboximidamide

Systemtic Name: N-[(E)-[4-(3-methylbutoxy)phenyl]methylideneamino]-N'-phenyl-1,3-benzothiazole-2-carboximidamide Openeye Name: N-[(E)-(4-isopentyloxyphenyl)methyleneamino]-N'-phenyl-1,3-benzothiazole-2-carboxamidine CAS Name: N-[(E)-[4-(3-methylbutoxy)phenyl]methylideneamino]-N'-phenyl-1,3-benzothiazole-2-carboximidamide IUPAC Name: N-[(E)-[4-(3-methylbutoxy)phenyl]methylideneamino]-N'-phenyl-1,3-benzothiazole-2-carboximidamide Traditional Name: N-[(E)-(4-isoamoxybenzylidene)amino]-N'-phenyl-1,3-benzothiazole-2-carboxamidine Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=NNC(=NC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)/C=N/NC(=NC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C26H26N4OS/c1-19(2)16-17-31-22-14-12-20(13-15-22)18-27-30-25(28-21-8-4-3-5-9-21)26-29-23-10-6-7-11-24(23)32-26/h3-15,18-19H,16-17H2,1-2H3,(H,28,30)/b27-18+