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

Systemtic Name: N-[(E)-(4-butylphenyl)methylideneamino]-N'-phenyl-1,3-benzothiazole-2-carboximidamide Openeye Name: N-[(E)-(4-butylphenyl)methyleneamino]-N'-phenyl-1,3-benzothiazole-2-carboxamidine CAS Name: N-[(E)-(4-butylphenyl)methylideneamino]-N'-phenyl-1,3-benzothiazole-2-carboximidamide IUPAC Name: N-[(E)-(4-butylphenyl)methylideneamino]-N'-phenyl-1,3-benzothiazole-2-carboximidamide Traditional Name: N-[(E)-(4-butylbenzylidene)amino]-N'-phenyl-1,3-benzothiazole-2-carboxamidine Formula: C25H24N4S MolecularWeight: 412.54986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C=NNC(=NC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCC1=CC=C(C=C1)/C=N/NC(=NC2=CC=CC=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H24N4S/c1-2-3-9-19-14-16-20(17-15-19)18-26-29-24(27-21-10-5-4-6-11-21)25-28-22-12-7-8-13-23(22)30-25/h4-8,10-18H,2-3,9H2,1H3,(H,27,29)/b26-18+