N-(2-tert-butyl-4-chloranyl-1,3-benzoxazol-6-yl)-4-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-tert-butyl-4-chloranyl-1,3-benzoxazol-6-yl)-4-methyl-piperazine-1-carbothioamide Openeye Name: N-(2-tert-butyl-4-chloro-1,3-benzoxazol-6-yl)-4-methyl-piperazine-1-carbothioamide CAS Name: N-(2-tert-butyl-4-chloro-1,3-benzoxazol-6-yl)-4-methyl-1-piperazinecarbothioamide IUPAC Name: N-(2-tert-butyl-4-chloro-1,3-benzoxazol-6-yl)-4-methylpiperazine-1-carbothioamide Traditional Name: N-(2-tert-butyl-4-chloro-1,3-benzoxazol-6-yl)-4-methyl-piperazine-1-carbothioamide Formula: C17H23ClN4OS MolecularWeight: 366.90872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(O1)C=C(C=C2Cl)NC(=S)N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=NC2=C(O1)C=C(C=C2Cl)NC(=S)N3CCN(CC3)C

InChI

InChI=1S/C17H23ClN4OS/c1-17(2,3)15-20-14-12(18)9-11(10-13(14)23-15)19-16(24)22-7-5-21(4)6-8-22/h9-10H,5-8H2,1-4H3,(H,19,24)