N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanyl-propanamide Openeye Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanyl-propanamide CAS Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(phenylthio)propanamide IUPAC Name: N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-phenylsulfanylpropanamide Traditional Name: N-(4-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-3-(phenylthio)propionamide Formula: C20H18N2O2S2 MolecularWeight: 382.49912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=NC(=O)CCSC3=CC=CC=C3)N2CC#C

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=NC(=O)CCSC3=CC=CC=C3)N2CC#C

InChI

InChI=1S/C20H18N2O2S2/c1-3-13-22-19-16(24-2)10-7-11-17(19)26-20(22)21-18(23)12-14-25-15-8-5-4-6-9-15/h1,4-11H,12-14H2,2H3