3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(2-oxo-3-propyl-benzimidazol-1-yl)propanamide CAS Name: 3-(2-oxo-3-propyl-1-benzimidazolyl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(2-keto-3-propyl-benzimidazol-1-yl)propionamide Formula: C22H23N5O2S2 MolecularWeight: 453.58032

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2S2/c1-2-13-26-17-10-6-7-11-18(17)27(22(26)29)14-12-19(28)23-20-24-25-21(31-20)30-15-16-8-4-3-5-9-16/h3-11H,2,12-15H2,1H3,(H,23,24,28)