N-(3-chloranyl-4-methoxy-phenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-5-methyl-4-(4-phenyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-5-methyl-4-(4-phenylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H24ClN5O2S MolecularWeight: 494.00836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)NC5=CC(=C(C=C5)OC)Cl

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)NC5=CC(=C(C=C5)OC)Cl

InChI

InChI=1S/C25H24ClN5O2S/c1-16-21-23(31-12-10-30(11-13-31)18-6-4-3-5-7-18)27-15-28-25(21)34-22(16)24(32)29-17-8-9-20(33-2)19(26)14-17/h3-9,14-15H,10-13H2,1-2H3,(H,29,32)