[4-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-[5-(4-bromophenyl)-4-thieno[2,3-d]pyrimidinyl]-1-piperazinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]piperazino]-pyrrolidino-methanone Formula: C21H22BrN5OS MolecularWeight: 472.40128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N2CCN(CC2)C3=C4C(=CSC4=NC=N3)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CCN(C1)C(=O)N2CCN(CC2)C3=C4C(=CSC4=NC=N3)C5=CC=C(C=C5)Br

InChI

InChI=1S/C21H22BrN5OS/c22-16-5-3-15(4-6-16)17-13-29-20-18(17)19(23-14-24-20)25-9-11-27(12-10-25)21(28)26-7-1-2-8-26/h3-6,13-14H,1-2,7-12H2