N-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-morpholinosulfonylphenyl)prop-2-enamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(4-morpholinosulfonylphenyl)acrylamide Formula: C21H21N3O4S2 MolecularWeight: 443.53914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H21N3O4S2/c1-15-22-19-8-5-17(14-20(19)29-15)23-21(25)9-4-16-2-6-18(7-3-16)30(26,27)24-10-12-28-13-11-24/h2-9,14H,10-13H2,1H3,(H,23,25)