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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-methyl-4-morpholin-4-ylsulfonyl-N-prop-2-enyl-pyrrole-2-carboxamide Openeye Name: N-allyl-N-(1,3-benzothiazol-2-yl)-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-methyl-4-(4-morpholinylsulfonyl)-N-prop-2-enyl-2-pyrrolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-methyl-4-morpholin-4-ylsulfonyl-N-prop-2-enylpyrrole-2-carboxamide Traditional Name: N-allyl-N-(1,3-benzothiazol-2-yl)-1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N(CC=C)C2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)N(CC=C)C2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H22N4O4S2/c1-3-8-24(20-21-16-6-4-5-7-18(16)29-20)19(25)17-13-15(14-22(17)2)30(26,27)23-9-11-28-12-10-23/h3-7,13-14H,1,8-12H2,2H3