N-(5-chloranyl-2-methoxy-phenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-(3-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Formula: C18H20ClN3O2S MolecularWeight: 377.8883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)N2CCN(CC2)C3=CC(=CC=C3)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)N2CCN(CC2)C3=CC(=CC=C3)O

InChI

InChI=1S/C18H20ClN3O2S/c1-24-17-6-5-13(19)11-16(17)20-18(25)22-9-7-21(8-10-22)14-3-2-4-15(23)12-14/h2-6,11-12,23H,7-10H2,1H3,(H,20,25)