4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(5-methylfuran-2-yl)methylideneamino]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(5-methylfuran-2-yl)methylideneamino]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(5-methyl-2-furyl)methyleneamino]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(E)-(5-methyl-2-furanyl)methylideneamino]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[(E)-(5-methylfuran-2-yl)methylideneamino]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[(E)-(5-methyl-2-furyl)methyleneamino]benzamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(O1)/C=N/NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H17N3O2S2/c1-14-6-11-17(26-14)12-22-24-20(25)16-9-7-15(8-10-16)13-27-21-23-18-4-2-3-5-19(18)28-21/h2-12H,13H2,1H3,(H,24,25)/b22-12+