(3-methyl-4-propan-2-yl-phenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: (3-methyl-4-propan-2-yl-phenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (4-isopropyl-3-methyl-phenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (3-methyl-4-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-4-propan-2-ylphenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (4-isopropyl-3-methyl-phenyl) ester Formula: C20H19NO2S MolecularWeight: 337.43536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C=CC2=NC3=CC=CC=C3S2)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)/C=C/C2=NC3=CC=CC=C3S2)C(C)C

InChI

InChI=1S/C20H19NO2S/c1-13(2)16-9-8-15(12-14(16)3)23-20(22)11-10-19-21-17-6-4-5-7-18(17)24-19/h4-13H,1-3H3/b11-10+