N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(2-ethoxyphenyl)piperazine-1-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(2-ethoxyphenyl)piperazine-1-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(2-ethoxyphenyl)piperazine-1-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-(2-ethoxyphenyl)-1-piperazinecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(2-ethoxyphenyl)piperazine-1-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-o-phenetyl-piperazine-1-carboxamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C23H28N4O2S/c1-2-29-22-10-6-5-9-21(22)26-12-14-27(15-13-26)23(28)25-11-16-30-18-20-8-4-3-7-19(20)17-24/h3-10H,2,11-16,18H2,1H3,(H,25,28)