N-(2-methoxyethyl)-2-[4-[(4-methoxyphenyl)carbamothioyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-methoxyethyl)-2-[4-[(4-methoxyphenyl)carbamothioyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-methoxyethyl)-2-[4-[(4-methoxyphenyl)carbamothioyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(4-methoxyanilino)-sulfanylidenemethyl]-1-piperazin-1-iumyl]-N-(2-methoxyethyl)acetamide IUPAC Name: N-(2-methoxyethyl)-2-[4-[(4-methoxyphenyl)carbamothioyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-methoxyethyl)-2-[4-[(4-methoxyphenyl)thiocarbamoyl]piperazin-1-ium-1-yl]acetamide Formula: C17H27N4O3S+ MolecularWeight: 367.48628

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C[NH+]1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC

Isomeric SMILES

COCCNC(=O)C[NH+]1CCN(CC1)C(=S)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H26N4O3S/c1-23-12-7-18-16(22)13-20-8-10-21(11-9-20)17(25)19-14-3-5-15(24-2)6-4-14/h3-6H,7-13H2,1-2H3,(H,18,22)(H,19,25)/p+1