2-(2-cyclopropyl-1-piperazin-1-yl-ethyl)-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(2-cyclopropyl-1-piperazin-1-yl-ethyl)-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-2-(2-cyclopropyl-1-piperazin-1-yl-ethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-cyclopropyl-1-(1-piperazinyl)ethyl]-3-(phenylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-benzyl-2-(2-cyclopropyl-1-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-2-(2-cyclopropyl-1-piperazino-ethyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CC(C2=NC3=C(C=CS3)C(=O)N2CC4=CC=CC=C4)N5CCNCC5

Isomeric SMILES

C1CC1CC(C2=NC3=C(C=CS3)C(=O)N2CC4=CC=CC=C4)N5CCNCC5

InChI

InChI=1S/C22H26N4OS/c27-22-18-8-13-28-21(18)24-20(26(22)15-17-4-2-1-3-5-17)19(14-16-6-7-16)25-11-9-23-10-12-25/h1-5,8,13,16,19,23H,6-7,9-12,14-15H2