N-(2-tert-butyl-5-methoxy-1,3-benzothiazol-6-yl)-4-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-tert-butyl-5-methoxy-1,3-benzothiazol-6-yl)-4-methyl-piperazine-1-carbothioamide Openeye Name: N-(2-tert-butyl-5-methoxy-1,3-benzothiazol-6-yl)-4-methyl-piperazine-1-carbothioamide CAS Name: N-(2-tert-butyl-5-methoxy-1,3-benzothiazol-6-yl)-4-methyl-1-piperazinecarbothioamide IUPAC Name: N-(2-tert-butyl-5-methoxy-1,3-benzothiazol-6-yl)-4-methylpiperazine-1-carbothioamide Traditional Name: N-(2-tert-butyl-5-methoxy-1,3-benzothiazol-6-yl)-4-methyl-piperazine-1-carbothioamide Formula: C18H26N4OS2 MolecularWeight: 378.55524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=C(C=C2S1)NC(=S)N3CCN(CC3)C)OC

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=C(C=C2S1)NC(=S)N3CCN(CC3)C)OC

InChI

InChI=1S/C18H26N4OS2/c1-18(2,3)16-19-13-10-14(23-5)12(11-15(13)25-16)20-17(24)22-8-6-21(4)7-9-22/h10-11H,6-9H2,1-5H3,(H,20,24)