4-[(5-chloranylthiophen-2-yl)methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(5-chloro-2-thienyl)methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl]-N-(4-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(5-chlorothiophen-2-yl)methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[(5-chloro-2-thienyl)methyl]-N-p-phenetyl-piperazine-1-carbothioamide Formula: C18H22ClN3OS2 MolecularWeight: 395.96978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C18H22ClN3OS2/c1-2-23-15-5-3-14(4-6-15)20-18(24)22-11-9-21(10-12-22)13-16-7-8-17(19)25-16/h3-8H,2,9-13H2,1H3,(H,20,24)