2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-pentoxyphenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-pentoxyphenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-pentoxyphenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(4-pentoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-pentoxyphenyl)methylideneamino]acetamide Traditional Name: N-[(E)-(4-amoxybenzylidene)amino]-2-(1,3-benzothiazol-2-ylthio)acetamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H23N3O2S2/c1-2-3-6-13-26-17-11-9-16(10-12-17)14-22-24-20(25)15-27-21-23-18-7-4-5-8-19(18)28-21/h4-5,7-12,14H,2-3,6,13,15H2,1H3,(H,24,25)/b22-14+