N-(4-ethoxyphenyl)-4-[2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide Openeye Name: N-(4-ethoxyphenyl)-4-[2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide CAS Name: 4-[2-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]ethyl]-N-(4-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-ethoxyphenyl)-4-[2-[(4-ethoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide Traditional Name: N-p-phenetyl-4-[2-(p-phenetylthiocarbamoylamino)ethyl]piperazine-1-carbothioamide Formula: C24H33N5O2S2 MolecularWeight: 487.68112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NCCN2CCN(CC2)C(=S)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NCCN2CCN(CC2)C(=S)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C24H33N5O2S2/c1-3-30-21-9-5-19(6-10-21)26-23(32)25-13-14-28-15-17-29(18-16-28)24(33)27-20-7-11-22(12-8-20)31-4-2/h5-12H,3-4,13-18H2,1-2H3,(H,27,33)(H2,25,26,32)