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

Systemtic Name: methyl 3-(2-cyclopropylcarbonylimino-6-methyl-1,3-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-[2-(cyclopropanecarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[cyclopropyl(oxo)methyl]imino-6-methyl-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(cyclopropanecarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(cyclopropanecarbonylimino)-6-methyl-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C16H18N2O3S MolecularWeight: 318.39072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CCC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CCC(=O)OC

InChI

InChI=1S/C16H18N2O3S/c1-10-3-6-12-13(9-10)22-16(17-15(20)11-4-5-11)18(12)8-7-14(19)21-2/h3,6,9,11H,4-5,7-8H2,1-2H3