[5-[(4,4-dimethylpiperidin-1-yl)carbothioylamino]pyridin-2-yl] N-methyl-N-phenyl-carbamate

Systemtic Name: [5-[(4,4-dimethylpiperidin-1-yl)carbothioylamino]pyridin-2-yl] N-methyl-N-phenyl-carbamate Openeye Name: [5-[(4,4-dimethylpiperidine-1-carbothioyl)amino]-2-pyridyl] N-methyl-N-phenyl-carbamate CAS Name: N-methyl-N-phenylcarbamic acid [5-[[(4,4-dimethyl-1-piperidinyl)-sulfanylidenemethyl]amino]-2-pyridinyl] ester IUPAC Name: [5-[(4,4-dimethylpiperidine-1-carbothioyl)amino]pyridin-2-yl] N-methyl-N-phenylcarbamate Traditional Name: N-methyl-N-phenyl-carbamic acid [5-[(4,4-dimethylpiperidine-1-carbothioyl)amino]-2-pyridyl] ester Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C(=S)NC2=CN=C(C=C2)OC(=O)N(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CCN(CC1)C(=S)NC2=CN=C(C=C2)OC(=O)N(C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H26N4O2S/c1-21(2)11-13-25(14-12-21)19(28)23-16-9-10-18(22-15-16)27-20(26)24(3)17-7-5-4-6-8-17/h4-10,15H,11-14H2,1-3H3,(H,23,28)