5-[2-(pyrimidin-2-ylamino)ethyl]-4-pyrrolidin-3-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine

Systemtic Name: 5-[2-(pyrimidin-2-ylamino)ethyl]-4-pyrrolidin-3-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine Openeye Name: 5-[2-(pyrimidin-2-ylamino)ethyl]-4-pyrrolidin-3-yl-1-(thiazol-4-ylmethyl)benzimidazol-2-amine CAS Name: 5-[2-(2-pyrimidinylamino)ethyl]-4-(3-pyrrolidinyl)-1-(4-thiazolylmethyl)-2-benzimidazolamine IUPAC Name: 5-[2-(pyrimidin-2-ylamino)ethyl]-4-pyrrolidin-3-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-amine Traditional Name: 2-[2-amino-4-pyrrolidin-3-yl-1-(thiazol-4-ylmethyl)benzimidazol-5-yl]ethyl-(2-pyrimidyl)amine Formula: C21H24N8S MolecularWeight: 420.53386

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C2=C(C=CC3=C2N=C(N3CC4=CSC=N4)N)CCNC5=NC=CC=N5

Isomeric SMILES

C1CNCC1C2=C(C=CC3=C2N=C(N3CC4=CSC=N4)N)CCNC5=NC=CC=N5

InChI

InChI=1S/C21H24N8S/c22-20-28-19-17(29(20)11-16-12-30-13-27-16)3-2-14(18(19)15-4-8-23-10-15)5-9-26-21-24-6-1-7-25-21/h1-3,6-7,12-13,15,23H,4-5,8-11H2,(H2,22,28)(H,24,25,26)