N-[4-[[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbothioylamino]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbothioylamino]phenyl]ethanamide Openeye Name: N-[4-[[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbothioyl]amino]phenyl]acetamide CAS Name: N-[4-[[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-[[4-(5-chloro-2-methylphenyl)piperazine-1-carbothioyl]amino]phenyl]acetamide Traditional Name: N-[4-[[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbothioyl]amino]phenyl]acetamide Formula: C20H23ClN4OS MolecularWeight: 402.94082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H23ClN4OS/c1-14-3-4-16(21)13-19(14)24-9-11-25(12-10-24)20(27)23-18-7-5-17(6-8-18)22-15(2)26/h3-8,13H,9-12H2,1-2H3,(H,22,26)(H,23,27)