methyl 2-(4-methoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(4-methoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(4-methoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[4-methoxy-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(4-methoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4-methoxy-2-valerylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=C(C=CC=C2S1)OC)CC(=O)OC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=C(C=CC=C2S1)OC)CC(=O)OC

InChI

InChI=1S/C16H20N2O4S/c1-4-5-9-13(19)17-16-18(10-14(20)22-3)15-11(21-2)7-6-8-12(15)23-16/h6-8H,4-5,9-10H2,1-3H3