N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-4-morpholinosulfonyl-benzamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-4-morpholinosulfonyl-benzamide Formula: C25H25N3O5S2 MolecularWeight: 511.6131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CO3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CO3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H25N3O5S2/c1-17-14-22-23(15-18(17)2)34-25(26-22)28(16-20-4-3-11-33-20)24(29)19-5-7-21(8-6-19)35(30,31)27-9-12-32-13-10-27/h3-8,11,14-15H,9-10,12-13,16H2,1-2H3