N'-(4-ethoxyphenyl)-N-(indol-3-ylidenemethylamino)-1,3-benzothiazole-2-carboximidamide

Systemtic Name: N'-(4-ethoxyphenyl)-N-(indol-3-ylidenemethylamino)-1,3-benzothiazole-2-carboximidamide Openeye Name: N'-(4-ethoxyphenyl)-N-(indol-3-ylidenemethylamino)-1,3-benzothiazole-2-carboxamidine CAS Name: N'-(4-ethoxyphenyl)-N-(3-indolylidenemethylamino)-1,3-benzothiazole-2-carboximidamide IUPAC Name: N'-(4-ethoxyphenyl)-N-(indol-3-ylidenemethylamino)-1,3-benzothiazole-2-carboximidamide Traditional Name: N-(indol-3-ylidenemethylamino)-N'-p-phenetyl-1,3-benzothiazole-2-carboxamidine Formula: C25H21N5OS MolecularWeight: 439.53214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C(C2=NC3=CC=CC=C3S2)NNC=C4C=NC5=CC=CC=C54

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C(C2=NC3=CC=CC=C3S2)NNC=C4C=NC5=CC=CC=C54

InChI

InChI=1S/C25H21N5OS/c1-2-31-19-13-11-18(12-14-19)28-24(25-29-22-9-5-6-10-23(22)32-25)30-27-16-17-15-26-21-8-4-3-7-20(17)21/h3-16,27H,2H2,1H3,(H,28,30)