4-(3-chloranylpyridin-2-yl)-2-propan-2-yl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3-chloranylpyridin-2-yl)-2-propan-2-yl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(3-chloro-2-pyridyl)-2-isopropyl-N-(4-isopropylphenyl)piperazine-1-carbothioamide CAS Name: 4-(3-chloro-2-pyridinyl)-2-propan-2-yl-N-(4-propan-2-ylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-chloropyridin-2-yl)-2-propan-2-yl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(3-chloro-2-pyridyl)-2-isopropyl-N-p-cumenyl-piperazine-1-carbothioamide Formula: C22H29ClN4S MolecularWeight: 417.01046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C(=S)NC2=CC=C(C=C2)C(C)C)C3=C(C=CC=N3)Cl

Isomeric SMILES

CC(C)C1CN(CCN1C(=S)NC2=CC=C(C=C2)C(C)C)C3=C(C=CC=N3)Cl

InChI

InChI=1S/C22H29ClN4S/c1-15(2)17-7-9-18(10-8-17)25-22(28)27-13-12-26(14-20(27)16(3)4)21-19(23)6-5-11-24-21/h5-11,15-16,20H,12-14H2,1-4H3,(H,25,28)