N-[6-ethyl-4-[4-(4-phenylphenyl)carbonylpiperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]-2-methyl-propanamide

Systemtic Name: N-[6-ethyl-4-[4-(4-phenylphenyl)carbonylpiperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]-2-methyl-propanamide Openeye Name: N-[6-ethyl-4-[4-(4-phenylbenzoyl)piperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]-2-methyl-propanamide CAS Name: N-[6-ethyl-4-[4-[oxo-(4-phenylphenyl)methyl]-1-piperazinyl]-2-thieno[2,3-d]pyrimidinyl]-2-methylpropanamide IUPAC Name: N-[6-ethyl-4-[4-(4-phenylbenzoyl)piperazin-1-yl]thieno[2,3-d]pyrimidin-2-yl]-2-methylpropanamide Traditional Name: N-[6-ethyl-4-[4-(4-phenylbenzoyl)piperazino]thieno[2,3-d]pyrimidin-2-yl]-2-methyl-propionamide Formula: C29H31N5O2S MolecularWeight: 513.65374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)NC(=O)C(C)C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)NC(=O)C(C)C)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O2S/c1-4-23-18-24-25(30-29(32-27(24)37-23)31-26(35)19(2)3)33-14-16-34(17-15-33)28(36)22-12-10-21(11-13-22)20-8-6-5-7-9-20/h5-13,18-19H,4,14-17H2,1-3H3,(H,30,31,32,35)