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

Systemtic Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-ethanamide Openeye Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-acetamide CAS Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenylacetamide IUPAC Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2,2-diphenylacetamide Traditional Name: N-(6-acetamido-3-propargyl-1,3-benzothiazol-2-ylidene)-2,2-diphenyl-acetamide Formula: C26H21N3O2S MolecularWeight: 439.52884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)S2)CC#C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)S2)CC#C

InChI

InChI=1S/C26H21N3O2S/c1-3-16-29-22-15-14-21(27-18(2)30)17-23(22)32-26(29)28-25(31)24(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h1,4-15,17,24H,16H2,2H3,(H,27,30)