N-(3-chloranyl-4-methyl-phenyl)-2-methyl-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-methyl-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Openeye Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-chloro-4-methyl-phenyl)-2-methyl-piperazine-1-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-2-methyl-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinecarboxamide IUPAC Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-chloro-4-methylphenyl)-2-methylpiperazine-1-carboxamide Traditional Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-chloro-4-methyl-phenyl)-2-methyl-piperazine-1-carboxamide Formula: C22H24ClN5OS MolecularWeight: 441.97686

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC(=C(C=C2)C)Cl)C3=NC(=NS3)CC4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC(=C(C=C2)C)Cl)C3=NC(=NS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24ClN5OS/c1-15-8-9-18(13-19(15)23)24-21(29)28-11-10-27(14-16(28)2)22-25-20(26-30-22)12-17-6-4-3-5-7-17/h3-9,13,16H,10-12,14H2,1-2H3,(H,24,29)