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

Systemtic Name: methyl 2-(2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-valerylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O3S/c1-3-4-9-13(18)16-15-17(10-14(19)20-2)11-7-5-6-8-12(11)21-15/h5-8H,3-4,9-10H2,1-2H3