3-methyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,2-oxazole-5-carboxamide

Systemtic Name: 3-methyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,2-oxazole-5-carboxamide Openeye Name: 3-methyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)isoxazole-5-carboxamide CAS Name: 3-methyl-N-[6-(methylthio)-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene]-5-isoxazolecarboxamide IUPAC Name: 3-methyl-N-(6-methylsulfanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1,2-oxazole-5-carboxamide Traditional Name: 3-methyl-N-[6-(methylthio)-3-propargyl-1,3-benzothiazol-2-ylidene]isoxazole-5-carboxamide Formula: C16H13N3O2S2 MolecularWeight: 343.42332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)CC#C

Isomeric SMILES

CC1=NOC(=C1)C(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)CC#C

InChI

InChI=1S/C16H13N3O2S2/c1-4-7-19-12-6-5-11(22-3)9-14(12)23-16(19)17-15(20)13-8-10(2)18-21-13/h1,5-6,8-9H,7H2,2-3H3