N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-N'-(4-methylpyridin-2-yl)butanediamide

Systemtic Name: N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-N'-(4-methylpyridin-2-yl)butanediamide Openeye Name: N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-N'-(4-methyl-2-pyridyl)butanediamide CAS Name: N-[2-[(3-methoxy-3-methylbutyl)thio]-1,3-benzothiazol-6-yl]-N'-(4-methyl-2-pyridinyl)butanediamide IUPAC Name: N-[2-(3-methoxy-3-methylbutyl)sulfanyl-1,3-benzothiazol-6-yl]-N'-(4-methylpyridin-2-yl)butanediamide Traditional Name: N-[2-[(3-methoxy-3-methyl-butyl)thio]-1,3-benzothiazol-6-yl]-N'-(4-methyl-2-pyridyl)succinamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=O)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

Isomeric SMILES

CC1=CC(=NC=C1)NC(=O)CCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCCC(C)(C)OC

InChI

InChI=1S/C23H28N4O3S2/c1-15-9-11-24-19(13-15)27-21(29)8-7-20(28)25-16-5-6-17-18(14-16)32-22(26-17)31-12-10-23(2,3)30-4/h5-6,9,11,13-14H,7-8,10,12H2,1-4H3,(H,25,28)(H,24,27,29)