4-methoxy-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-methoxy-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]cyclohexane-1-carboxamide Openeye Name: 4-methoxy-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]cyclohexanecarboxamide CAS Name: 4-methoxy-N-[2-[(3-methoxy-3-methylbutyl)thio]-1,3-benzothiazol-6-yl]-1-cyclohexanecarboxamide IUPAC Name: 4-methoxy-N-[2-(3-methoxy-3-methylbutyl)sulfanyl-1,3-benzothiazol-6-yl]cyclohexane-1-carboxamide Traditional Name: 4-methoxy-N-[2-[(3-methoxy-3-methyl-butyl)thio]-1,3-benzothiazol-6-yl]cyclohexanecarboxamide Formula: C21H30N2O3S2 MolecularWeight: 422.6045

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CCC(CC3)OC)OC

Isomeric SMILES

CC(C)(CCSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CCC(CC3)OC)OC

InChI

InChI=1S/C21H30N2O3S2/c1-21(2,26-4)11-12-27-20-23-17-10-7-15(13-18(17)28-20)22-19(24)14-5-8-16(25-3)9-6-14/h7,10,13-14,16H,5-6,8-9,11-12H2,1-4H3,(H,22,24)