N4-cyclopropyl-N2-(3-fluoranyl-4-piperazin-1-yl-phenyl)thieno[3,2-d]pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopropyl-N2-(3-fluoranyl-4-piperazin-1-yl-phenyl)thieno[3,2-d]pyrimidine-2,4-diamine Openeye Name: N4-cyclopropyl-N2-(3-fluoro-4-piperazin-1-yl-phenyl)thieno[3,2-d]pyrimidine-2,4-diamine CAS Name: N4-cyclopropyl-N2-[3-fluoro-4-(1-piperazinyl)phenyl]thieno[3,2-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopropyl-2-N-(3-fluoro-4-piperazin-1-ylphenyl)thieno[3,2-d]pyrimidine-2,4-diamine Traditional Name: cyclopropyl-[2-(3-fluoro-4-piperazino-anilino)thieno[3,2-d]pyrimidin-4-yl]amine Formula: C19H21FN6S MolecularWeight: 384.473643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC3=C2SC=C3)NC4=CC(=C(C=C4)N5CCNCC5)F

Isomeric SMILES

C1CC1NC2=NC(=NC3=C2SC=C3)NC4=CC(=C(C=C4)N5CCNCC5)F

InChI

InChI=1S/C19H21FN6S/c20-14-11-13(3-4-16(14)26-8-6-21-7-9-26)23-19-24-15-5-10-27-17(15)18(25-19)22-12-1-2-12/h3-5,10-12,21H,1-2,6-9H2,(H2,22,23,24,25)