N-[[4-(cycloheptylamino)thieno[2,3-d]pyrimidin-6-yl]methyl]-1,2-oxazol-3-amine

Systemtic Name: N-[[4-(cycloheptylamino)thieno[2,3-d]pyrimidin-6-yl]methyl]-1,2-oxazol-3-amine Openeye Name: N-[[4-(cycloheptylamino)thieno[2,3-d]pyrimidin-6-yl]methyl]isoxazol-3-amine CAS Name: N-[[4-(cycloheptylamino)-6-thieno[2,3-d]pyrimidinyl]methyl]-3-isoxazolamine IUPAC Name: N-[[4-(cycloheptylamino)thieno[2,3-d]pyrimidin-6-yl]methyl]-1,2-oxazol-3-amine Traditional Name: cycloheptyl-[6-[(isoxazol-3-ylamino)methyl]thieno[2,3-d]pyrimidin-4-yl]amine Formula: C17H21N5OS MolecularWeight: 343.44654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=C3C=C(SC3=NC=N2)CNC4=NOC=C4

Isomeric SMILES

C1CCCC(CC1)NC2=C3C=C(SC3=NC=N2)CNC4=NOC=C4

InChI

InChI=1S/C17H21N5OS/c1-2-4-6-12(5-3-1)21-16-14-9-13(24-17(14)20-11-19-16)10-18-15-7-8-23-22-15/h7-9,11-12H,1-6,10H2,(H,18,22)(H,19,20,21)