4-(2-chlorophenyl)carbonyl-N-(4-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2-chlorophenyl)carbonyl-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2-chlorobenzoyl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[(2-chlorophenyl)-oxomethyl]-N-(4-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2-chlorobenzoyl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2-chlorobenzoyl)-N-p-phenetyl-piperazine-1-carbothioamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-2-26-16-9-7-15(8-10-16)22-20(27)24-13-11-23(12-14-24)19(25)17-5-3-4-6-18(17)21/h3-10H,2,11-14H2,1H3,(H,22,27)