N-(4-ethoxyphenyl)-4-[methyl(2-morpholin-4-ylethyl)amino]piperidine-1-carbothioamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[methyl(2-morpholin-4-ylethyl)amino]piperidine-1-carbothioamide Openeye Name: N-(4-ethoxyphenyl)-4-[methyl(2-morpholinoethyl)amino]piperidine-1-carbothioamide CAS Name: N-(4-ethoxyphenyl)-4-[methyl-[2-(4-morpholinyl)ethyl]amino]-1-piperidinecarbothioamide IUPAC Name: N-(4-ethoxyphenyl)-4-[methyl(2-morpholin-4-ylethyl)amino]piperidine-1-carbothioamide Traditional Name: 4-[methyl(2-morpholinoethyl)amino]-N-p-phenetyl-piperidine-1-carbothioamide Formula: C21H34N4O2S MolecularWeight: 406.58526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCC(CC2)N(C)CCN3CCOCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCC(CC2)N(C)CCN3CCOCC3

InChI

InChI=1S/C21H34N4O2S/c1-3-27-20-6-4-18(5-7-20)22-21(28)25-10-8-19(9-11-25)23(2)12-13-24-14-16-26-17-15-24/h4-7,19H,3,8-17H2,1-2H3,(H,22,28)