4-(1,4-diazepan-1-yl)-5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-(1,4-diazepan-1-yl)-5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidine Openeye Name: 4-(1,4-diazepan-1-yl)-5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidine CAS Name: 4-(1,4-diazepan-1-yl)-5-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidine IUPAC Name: 4-(1,4-diazepan-1-yl)-5-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidine Traditional Name: 4-(1,4-diazepan-1-yl)-5-(4-fluorophenyl)-6-methyl-thieno[2,3-d]pyrimidine Formula: C18H19FN4S MolecularWeight: 342.433663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)N3CCCNCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)N3CCCNCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H19FN4S/c1-12-15(13-3-5-14(19)6-4-13)16-17(21-11-22-18(16)24-12)23-9-2-7-20-8-10-23/h3-6,11,20H,2,7-10H2,1H3