4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(5-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-(2,6-dimethylmorpholino)sulfonyl-N-(5-nitro-3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C23H22N4O6S2 MolecularWeight: 514.57398

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC(=C4)[N+](=O)[O-])CC#C

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC(=C4)[N+](=O)[O-])CC#C

InChI

InChI=1S/C23H22N4O6S2/c1-4-11-26-20-12-18(27(29)30)7-10-21(20)34-23(26)24-22(28)17-5-8-19(9-6-17)35(31,32)25-13-15(2)33-16(3)14-25/h1,5-10,12,15-16H,11,13-14H2,2-3H3