N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(3-methyl-2-oxo-benzimidazol-1-yl)propanamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(3-methyl-2-oxo-1-benzimidazolyl)propanamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-3-(2-keto-3-methyl-benzimidazol-1-yl)propionamide Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N4O2S/c1-24-16-8-3-4-9-17(16)25(21(24)27)14-12-19(26)22-13-6-11-20-23-15-7-2-5-10-18(15)28-20/h2-5,7-10H,6,11-14H2,1H3,(H,22,26)