methyl 3-(2-butanoylimino-6-propan-2-yl-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: methyl 3-(2-butanoylimino-6-propan-2-yl-1,3-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-(2-butanoylimino-6-isopropyl-1,3-benzothiazol-3-yl)propanoate CAS Name: 3-[2-(1-oxobutylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-(2-butanoylimino-6-propan-2-yl-1,3-benzothiazol-3-yl)propanoate Traditional Name: 3-(2-butyrylimino-6-isopropyl-1,3-benzothiazol-3-yl)propionic acid methyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)C(C)C)CCC(=O)OC

Isomeric SMILES

CCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)C(C)C)CCC(=O)OC

InChI

InChI=1S/C18H24N2O3S/c1-5-6-16(21)19-18-20(10-9-17(22)23-4)14-8-7-13(12(2)3)11-15(14)24-18/h7-8,11-12H,5-6,9-10H2,1-4H3