3-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[[5-(4-bromophenyl)-4-thieno[2,3-d]pyrimidinyl]amino]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]-1-pyrrolidino-propan-1-one Formula: C19H19BrN4OS MolecularWeight: 431.34936

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCNC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(C1)C(=O)CCNC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H19BrN4OS/c20-14-5-3-13(4-6-14)15-11-26-19-17(15)18(22-12-23-19)21-8-7-16(25)24-9-1-2-10-24/h3-6,11-12H,1-2,7-10H2,(H,21,22,23)