N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide

Systemtic Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-methyl-2-oxo-benzimidazol-1-yl)propanamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-methyl-2-oxo-1-benzimidazolyl)propanamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(2-keto-3-methyl-benzimidazol-1-yl)propionamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C4=CC=CC=C4N(C3=O)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C4=CC=CC=C4N(C3=O)C

InChI

InChI=1S/C22H24N4O2S/c1-3-4-7-15-10-11-16-19(14-15)29-21(23-16)24-20(27)12-13-26-18-9-6-5-8-17(18)25(2)22(26)28/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3,(H,23,24,27)