2-tert-butylsulfanyl-6-chloranyl-N-[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]-N-methyl-1H-benzimidazol-5-amine

Systemtic Name: 2-tert-butylsulfanyl-6-chloranyl-N-[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]-N-methyl-1H-benzimidazol-5-amine Openeye Name: 2-tert-butylsulfanyl-6-chloro-N-[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]-N-methyl-1H-benzimidazol-5-amine CAS Name: 2-(tert-butylthio)-6-chloro-N-[(3S)-1-(2-methoxyethyl)-3-pyrrolidinyl]-N-methyl-1H-benzimidazol-5-amine IUPAC Name: 2-tert-butylsulfanyl-6-chloro-N-[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]-N-methyl-1H-benzimidazol-5-amine Traditional Name: [2-(tert-butylthio)-6-chloro-1H-benzimidazol-5-yl]-[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]-methyl-amine Formula: C19H29ClN4OS MolecularWeight: 396.97776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=NC2=CC(=C(C=C2N1)Cl)N(C)C3CCN(C3)CCOC

Isomeric SMILES

CC(C)(C)SC1=NC2=CC(=C(C=C2N1)Cl)N(C)[C@H]3CCN(C3)CCOC

InChI

InChI=1S/C19H29ClN4OS/c1-19(2,3)26-18-21-15-10-14(20)17(11-16(15)22-18)23(4)13-6-7-24(12-13)8-9-25-5/h10-11,13H,6-9,12H2,1-5H3,(H,21,22)/t13-/m0/s1