cyclohexyl-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-azanium

Systemtic Name: cyclohexyl-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methyl-azanium Openeye Name: cyclohexyl-[1-[(3-methoxyphenyl)carbamothioyl]-4-piperidyl]-methyl-ammonium CAS Name: cyclohexyl-[1-[(3-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-methylammonium IUPAC Name: cyclohexyl-[1-[(3-methoxyphenyl)carbamothioyl]piperidin-4-yl]-methylazanium Traditional Name: cyclohexyl-[1-[(3-methoxyphenyl)thiocarbamoyl]-4-piperidyl]-methyl-ammonium Formula: C20H32N3OS+ MolecularWeight: 362.55258

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C1CCCCC1)C2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+](C1CCCCC1)C2CCN(CC2)C(=S)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H31N3OS/c1-22(17-8-4-3-5-9-17)18-11-13-23(14-12-18)20(25)21-16-7-6-10-19(15-16)24-2/h6-7,10,15,17-18H,3-5,8-9,11-14H2,1-2H3,(H,21,25)/p+1