N-(6-methoxy-1,3-benzothiazol-2-yl)-N'-[(E)-(4-methylphenyl)methylideneamino]butanediamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N'-[(E)-(4-methylphenyl)methylideneamino]butanediamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N'-[(E)-p-tolylmethyleneamino]butanediamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N'-[(E)-(4-methylphenyl)methylideneamino]butanediamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N'-[(E)-(4-methylphenyl)methylideneamino]butanediamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N'-[(E)-(4-methylbenzylidene)amino]succinamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=NNC(=O)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=N/NC(=O)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C20H20N4O3S/c1-13-3-5-14(6-4-13)12-21-24-19(26)10-9-18(25)23-20-22-16-8-7-15(27-2)11-17(16)28-20/h3-8,11-12H,9-10H2,1-2H3,(H,24,26)(H,22,23,25)/b21-12+