methyl 2-(5,7-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(5,7-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(5,7-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[5,7-dimethyl-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(5,7-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(5,7-dimethyl-2-valerylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3S/c1-5-6-7-14(20)18-17-19(10-15(21)22-4)13-9-11(2)8-12(3)16(13)23-17/h8-9H,5-7,10H2,1-4H3