2-chloranyl-1-[4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: 2-chloranyl-1-[4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 2-chloro-1-[4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenyl-ethanone CAS Name: 2-chloro-1-[4-(5,6-dimethyl-2-phenethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-2-phenylethanone IUPAC Name: 2-chloro-1-[4-(5,6-dimethyl-2-phenethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenylethanone Traditional Name: 2-chloro-1-[4-(5,6-dimethyl-2-phenethyl-thieno[2,3-d]pyrimidin-4-yl)piperazino]-2-phenyl-ethanone Formula: C28H29ClN4OS MolecularWeight: 505.07406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)Cl)CCC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C(=O)C(C4=CC=CC=C4)Cl)CCC5=CC=CC=C5)C

InChI

InChI=1S/C28H29ClN4OS/c1-19-20(2)35-27-24(19)26(30-23(31-27)14-13-21-9-5-3-6-10-21)32-15-17-33(18-16-32)28(34)25(29)22-11-7-4-8-12-22/h3-12,25H,13-18H2,1-2H3