4-morpholin-4-ylsulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-morpholin-4-ylsulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-morpholinosulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-(4-morpholinylsulfonyl)-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-morpholin-4-ylsulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-morpholinosulfonyl-N-(3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C#CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H19N3O4S2/c1-2-11-24-18-5-3-4-6-19(18)29-21(24)22-20(25)16-7-9-17(10-8-16)30(26,27)23-12-14-28-15-13-23/h1,3-10H,11-15H2