N-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]adamantane-1-carboxamide Openeye Name: N-[1-[(3-methoxyphenyl)carbamothioyl]-4-piperidyl]adamantane-1-carboxamide CAS Name: N-[1-[(3-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-1-adamantanecarboxamide IUPAC Name: N-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]adamantane-1-carboxamide Traditional Name: N-[1-[(3-methoxyphenyl)thiocarbamoyl]-4-piperidyl]adamantane-1-carboxamide Formula: C24H33N3O2S MolecularWeight: 427.60272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCC(CC2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC(CC2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H33N3O2S/c1-29-21-4-2-3-20(12-21)26-23(30)27-7-5-19(6-8-27)25-22(28)24-13-16-9-17(14-24)11-18(10-16)15-24/h2-4,12,16-19H,5-11,13-15H2,1H3,(H,25,28)(H,26,30)