N-(6-ethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-(6-ethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(6-ethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(6-ethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(6-ethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(6-ethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-tosyl-propionamide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)OCC)SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)OCC)SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H26N2O4S2/c1-4-13-24-19-11-8-17(28-5-2)15-20(19)29-22(24)23-21(25)12-14-30(26,27)18-9-6-16(3)7-10-18/h6-11,15H,4-5,12-14H2,1-3H3