6-chloranyl-2-pentan-3-ylsulfanyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1H-benzimidazol-5-amine

Systemtic Name: 6-chloranyl-2-pentan-3-ylsulfanyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1H-benzimidazol-5-amine Openeye Name: N-(1-benzylpyrrolidin-3-yl)-6-chloro-2-(1-ethylpropylsulfanyl)-1H-benzimidazol-5-amine CAS Name: 6-chloro-2-(pentan-3-ylthio)-N-[1-(phenylmethyl)-3-pyrrolidinyl]-1H-benzimidazol-5-amine IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-6-chloro-2-pentan-3-ylsulfanyl-1H-benzimidazol-5-amine Traditional Name: (1-benzylpyrrolidin-3-yl)-[6-chloro-2-(1-ethylpropylthio)-1H-benzimidazol-5-yl]amine Formula: C23H29ClN4S MolecularWeight: 429.02116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

CCC(CC)SC1=NC2=CC(=C(C=C2N1)Cl)NC3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29ClN4S/c1-3-18(4-2)29-23-26-21-12-19(24)20(13-22(21)27-23)25-17-10-11-28(15-17)14-16-8-6-5-7-9-16/h5-9,12-13,17-18,25H,3-4,10-11,14-15H2,1-2H3,(H,26,27)