methyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-4-methyl-pentanoate

Systemtic Name: methyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-4-methyl-pentanoate Openeye Name: methyl 2-(1,3-benzothiazole-6-carbonylamino)-4-methyl-pentanoate CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-(1,3-benzothiazole-6-carbonylamino)-4-methylpentanoate Traditional Name: 2-(1,3-benzothiazole-6-carbonylamino)-4-methyl-valeric acid methyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CC2=C(C=C1)N=CS2

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C1=CC2=C(C=C1)N=CS2

InChI

InChI=1S/C15H18N2O3S/c1-9(2)6-12(15(19)20-3)17-14(18)10-4-5-11-13(7-10)21-8-16-11/h4-5,7-9,12H,6H2,1-3H3,(H,17,18)