N-(2-methyl-1,3-benzothiazol-6-yl)-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-morpholinosulfonyl-1H-pyrrole-2-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-(4-morpholinylsulfonyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-4-morpholinosulfonyl-1H-pyrrole-2-carboxamide Formula: C17H18N4O4S2 MolecularWeight: 406.47922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CN3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=CN3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C17H18N4O4S2/c1-11-19-14-3-2-12(8-16(14)26-11)20-17(22)15-9-13(10-18-15)27(23,24)21-4-6-25-7-5-21/h2-3,8-10,18H,4-7H2,1H3,(H,20,22)