N-tert-butyl-2-[4-[(4-butylphenyl)carbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(4-butylphenyl)carbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[(4-butylphenyl)carbamothioyl]piperazin-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(4-butylanilino)-sulfanylidenemethyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[(4-butylphenyl)carbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[(4-butylphenyl)thiocarbamoyl]piperazino]acetamide Formula: C21H34N4OS MolecularWeight: 390.58586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC(=O)NC(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC(=O)NC(C)(C)C

InChI

InChI=1S/C21H34N4OS/c1-5-6-7-17-8-10-18(11-9-17)22-20(27)25-14-12-24(13-15-25)16-19(26)23-21(2,3)4/h8-11H,5-7,12-16H2,1-4H3,(H,22,27)(H,23,26)