(E)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(4-methyl-1,3-benzothiazol-2-yl)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-[4-(2-ketopyrrolidino)phenyl]-N-(4-methyl-1,3-benzothiazol-2-yl)acrylamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C=CC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)/C=C/C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C21H19N3O2S/c1-14-4-2-5-17-20(14)23-21(27-17)22-18(25)12-9-15-7-10-16(11-8-15)24-13-3-6-19(24)26/h2,4-5,7-12H,3,6,13H2,1H3,(H,22,23,25)/b12-9+