(E)-3-(2-butoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(2-butoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(2-butoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(2-butoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(2-butoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(2-butoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)acrylamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C=CC(=O)NC2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CCCCOC1=CC=CC=C1/C=C/C(=O)NC2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C21H22N2O2S/c1-3-4-13-25-18-8-6-5-7-16(18)10-12-20(24)23-21-22-17-11-9-15(2)14-19(17)26-21/h5-12,14H,3-4,13H2,1-2H3,(H,22,23,24)/b12-10+