N-(6-butyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-4-morpholinosulfonyl-benzamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-4-morpholinosulfonyl-benzamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H25N3O4S2/c1-2-3-4-16-5-10-19-20(15-16)30-22(23-19)24-21(26)17-6-8-18(9-7-17)31(27,28)25-11-13-29-14-12-25/h5-10,15H,2-4,11-14H2,1H3,(H,23,24,26)