N-[3,5-bis(chloranyl)pyridin-4-yl]-3-cyclopentyloxy-4-methoxy-benzenecarbothioamide

Systemtic Name: N-[3,5-bis(chloranyl)pyridin-4-yl]-3-cyclopentyloxy-4-methoxy-benzenecarbothioamide Openeye Name: 3-(cyclopentoxy)-N-(3,5-dichloro-4-pyridyl)-4-methoxy-benzenecarbothioamide CAS Name: 3-cyclopentyloxy-N-(3,5-dichloro-4-pyridinyl)-4-methoxybenzenecarbothioamide IUPAC Name: 3-cyclopentyloxy-N-(3,5-dichloropyridin-4-yl)-4-methoxybenzenecarbothioamide Traditional Name: 3-(cyclopentoxy)-N-(3,5-dichloro-4-pyridyl)-4-methoxy-thiobenzamide Formula: C18H18Cl2N2O2S MolecularWeight: 397.31872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=S)NC2=C(C=NC=C2Cl)Cl)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=S)NC2=C(C=NC=C2Cl)Cl)OC3CCCC3

InChI

InChI=1S/C18H18Cl2N2O2S/c1-23-15-7-6-11(8-16(15)24-12-4-2-3-5-12)18(25)22-17-13(19)9-21-10-14(17)20/h6-10,12H,2-5H2,1H3,(H,21,22,25)