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

Systemtic Name: N-[6-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]propanamide Openeye Name: N-[6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]propanamide CAS Name: N-[6-(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-1,3-benzothiazol-2-yl]propanamide IUPAC Name: N-[6-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]propanamide Traditional Name: N-[6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]propionamide Formula: C19H20N6OS MolecularWeight: 380.4667

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=CN(C4=C3C(=NC=N4)N)C(C)C

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)C3=CN(C4=C3C(=NC=N4)N)C(C)C

InChI

InChI=1S/C19H20N6OS/c1-4-15(26)24-19-23-13-6-5-11(7-14(13)27-19)12-8-25(10(2)3)18-16(12)17(20)21-9-22-18/h5-10H,4H2,1-3H3,(H2,20,21,22)(H,23,24,26)