N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-ethanamide

Systemtic Name: N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-ethanamide Openeye Name: N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-acetamide CAS Name: N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenylacetamide IUPAC Name: N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenylacetamide Traditional Name: N-(6-ethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-acetamide Formula: C26H22N2O2S MolecularWeight: 426.53008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)S2)CC#C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)S2)CC#C

InChI

InChI=1S/C26H22N2O2S/c1-3-17-28-22-16-15-21(30-4-2)18-23(22)31-26(28)27-25(29)24(19-11-7-5-8-12-19)20-13-9-6-10-14-20/h1,5-16,18,24H,4,17H2,2H3