methyl 2-[(4-methylpiperidin-1-yl)carbothioylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(4-methylpiperidin-1-yl)carbothioylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(4-methylpiperidine-1-carbothioyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-methylpiperidine-1-carbothioyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(4-methylpiperidine-1-carbothioyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H19N3O2S2 MolecularWeight: 349.47096

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)C(=S)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C16H19N3O2S2/c1-10-5-7-19(8-6-10)16(22)18-15-17-12-4-3-11(14(20)21-2)9-13(12)23-15/h3-4,9-10H,5-8H2,1-2H3,(H,17,18,22)