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

Systemtic Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-N'-(4-methylphenyl)-1,3-benzothiazole-2-carboximidamide Openeye Name: N-[(E)-(4-butoxyphenyl)methyleneamino]-N'-(p-tolyl)-1,3-benzothiazole-2-carboxamidine CAS Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-N'-(4-methylphenyl)-1,3-benzothiazole-2-carboximidamide IUPAC Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-N'-(4-methylphenyl)-1,3-benzothiazole-2-carboximidamide Traditional Name: N-[(E)-(4-butoxybenzylidene)amino]-N'-(p-tolyl)-1,3-benzothiazole-2-carboxamidine Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NNC(=NC2=CC=C(C=C2)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/NC(=NC2=CC=C(C=C2)C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C26H26N4OS/c1-3-4-17-31-22-15-11-20(12-16-22)18-27-30-25(28-21-13-9-19(2)10-14-21)26-29-23-7-5-6-8-24(23)32-26/h5-16,18H,3-4,17H2,1-2H3,(H,28,30)/b27-18+