(E)-3-(1,3-benzothiazol-2-yl)-N-(5-tert-butyl-2-methoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-tert-butyl-2-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-tert-butyl-2-methoxy-phenyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-tert-butyl-2-methoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-tert-butyl-2-methoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(5-tert-butyl-2-methoxy-phenyl)acrylamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H22N2O2S/c1-21(2,3)14-9-10-17(25-4)16(13-14)22-19(24)11-12-20-23-15-7-5-6-8-18(15)26-20/h5-13H,1-4H3,(H,22,24)/b12-11+