methyl 2-(2-cyclohexylcarbonylimino-6-methyl-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(2-cyclohexylcarbonylimino-6-methyl-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-[2-(cyclohexanecarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[cyclohexyl(oxo)methyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(cyclohexanecarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(cyclohexanecarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)C3CCCCC3)S2)CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)C3CCCCC3)S2)CC(=O)OC

InChI

InChI=1S/C18H22N2O3S/c1-12-8-9-14-15(10-12)24-18(20(14)11-16(21)23-2)19-17(22)13-6-4-3-5-7-13/h8-10,13H,3-7,11H2,1-2H3