N-[6-(furan-2-ylmethylsulfanyl)-1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl]-3-methyl-benzamide

Systemtic Name: N-[6-(furan-2-ylmethylsulfanyl)-1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl]-3-methyl-benzamide Openeye Name: N-[6-(2-furylmethylsulfanyl)-1,3-dimethyl-2-oxo-benzimidazol-5-yl]-3-methyl-benzamide CAS Name: N-[6-(2-furanylmethylthio)-1,3-dimethyl-2-oxo-5-benzimidazolyl]-3-methylbenzamide IUPAC Name: N-[6-(furan-2-ylmethylsulfanyl)-1,3-dimethyl-2-oxobenzimidazol-5-yl]-3-methylbenzamide Traditional Name: N-[6-(2-furfurylthio)-2-keto-1,3-dimethyl-benzimidazol-5-yl]-3-methyl-benzamide Formula: C22H21N3O3S MolecularWeight: 407.48544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C=C3C(=C2)N(C(=O)N3C)C)SCC4=CC=CO4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C=C3C(=C2)N(C(=O)N3C)C)SCC4=CC=CO4

InChI

InChI=1S/C22H21N3O3S/c1-14-6-4-7-15(10-14)21(26)23-17-11-18-19(25(3)22(27)24(18)2)12-20(17)29-13-16-8-5-9-28-16/h4-12H,13H2,1-3H3,(H,23,26)