methyl 4-[1,3-benzothiazol-2-yl(prop-2-enyl)carbamoyl]benzoate

Systemtic Name: methyl 4-[1,3-benzothiazol-2-yl(prop-2-enyl)carbamoyl]benzoate Openeye Name: methyl 4-[allyl(1,3-benzothiazol-2-yl)carbamoyl]benzoate CAS Name: 4-[[1,3-benzothiazol-2-yl(prop-2-enyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1,3-benzothiazol-2-yl(prop-2-enyl)carbamoyl]benzoate Traditional Name: 4-[allyl(1,3-benzothiazol-2-yl)carbamoyl]benzoic acid methyl ester Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N(CC=C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N(CC=C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H16N2O3S/c1-3-12-21(19-20-15-6-4-5-7-16(15)25-19)17(22)13-8-10-14(11-9-13)18(23)24-2/h3-11H,1,12H2,2H3