6-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-N-methyl-1,3-benzothiazol-2-amine

Systemtic Name: 6-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-N-methyl-1,3-benzothiazol-2-amine Openeye Name: 6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-N-methyl-1,3-benzothiazol-2-amine CAS Name: 6-(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-N-methyl-1,3-benzothiazol-2-amine IUPAC Name: 6-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-5-yl)-N-methyl-1,3-benzothiazol-2-amine Traditional Name: [6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]-methyl-amine Formula: C17H18N6S MolecularWeight: 338.43002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CN=C2N)C3=CC4=C(C=C3)N=C(S4)NC

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CN=C2N)C3=CC4=C(C=C3)N=C(S4)NC

InChI

InChI=1S/C17H18N6S/c1-9(2)23-7-11(14-15(18)20-8-21-16(14)23)10-4-5-12-13(6-10)24-17(19-3)22-12/h4-9H,1-3H3,(H,19,22)(H2,18,20,21)