N-[4,7-bis(chloranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-3-methylsulfanyl-benzamide

Systemtic Name: N-[4,7-bis(chloranyl)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-3-methylsulfanyl-benzamide Openeye Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-methylsulfanyl-benzamide CAS Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(methylthio)benzamide IUPAC Name: N-(4,7-dichloro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-methylsulfanylbenzamide Traditional Name: N-(4,7-dichloro-3-propargyl-1,3-benzothiazol-2-ylidene)-3-(methylthio)benzamide Formula: C18H12Cl2N2OS2 MolecularWeight: 407.33668

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)Cl)CC#C

Isomeric SMILES

CSC1=CC=CC(=C1)C(=O)N=C2N(C3=C(C=CC(=C3S2)Cl)Cl)CC#C

InChI

InChI=1S/C18H12Cl2N2OS2/c1-3-9-22-15-13(19)7-8-14(20)16(15)25-18(22)21-17(23)11-5-4-6-12(10-11)24-2/h1,4-8,10H,9H2,2H3