(E)-4-(1,3-benzothiazol-2-yl)-5-(4-propan-2-ylphenyl)pent-4-enoate

Systemtic Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-propan-2-ylphenyl)pent-4-enoate Openeye Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-isopropylphenyl)pent-4-enoate CAS Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-propan-2-ylphenyl)-4-pentenoate IUPAC Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(4-propan-2-ylphenyl)pent-4-enoate Traditional Name: (E)-4-(1,3-benzothiazol-2-yl)-5-p-cumenyl-pent-4-enoate Formula: C21H20NO2S- MolecularWeight: 350.454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(CCC(=O)[O-])C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\CCC(=O)[O-])/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C21H21NO2S/c1-14(2)16-9-7-15(8-10-16)13-17(11-12-20(23)24)21-22-18-5-3-4-6-19(18)25-21/h3-10,13-14H,11-12H2,1-2H3,(H,23,24)/p-1/b17-13+