N-(5-chloranyl-2-methoxy-phenyl)-4-(oxolan-2-ylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-(oxolan-2-ylcarbonyl)piperazine-1-carbothioamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-[oxo(2-oxolanyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-(oxolane-2-carbonyl)piperazine-1-carbothioamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioamide Formula: C17H22ClN3O3S MolecularWeight: 383.89288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)N2CCN(CC2)C(=O)C3CCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)N2CCN(CC2)C(=O)C3CCCO3

InChI

InChI=1S/C17H22ClN3O3S/c1-23-14-5-4-12(18)11-13(14)19-17(25)21-8-6-20(7-9-21)16(22)15-3-2-10-24-15/h4-5,11,15H,2-3,6-10H2,1H3,(H,19,25)