4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(Z)-2-methylpentan-3-ylideneamino]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(Z)-2-methylpentan-3-ylideneamino]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(Z)-(1-ethyl-2-methyl-propylidene)amino]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(Z)-2-methylpentan-3-ylideneamino]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(Z)-2-methylpentan-3-ylideneamino]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(Z)-(1-ethyl-2-methyl-propylidene)amino]benzamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3OS2/c1-4-17(14(2)3)23-24-20(25)16-11-9-15(10-12-16)13-26-21-22-18-7-5-6-8-19(18)27-21/h5-12,14H,4,13H2,1-3H3,(H,24,25)/b23-17-