N-(1,3-dithiolan-2-ylmethyl)-6-(4-methoxyphenyl)-5-phenyl-furo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(1,3-dithiolan-2-ylmethyl)-6-(4-methoxyphenyl)-5-phenyl-furo[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-dithiolan-2-ylmethyl)-6-(4-methoxyphenyl)-5-phenyl-furo[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-dithiolan-2-ylmethyl)-6-(4-methoxyphenyl)-5-phenyl-4-furo[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-dithiolan-2-ylmethyl)-6-(4-methoxyphenyl)-5-phenylfuro[2,3-d]pyrimidin-4-amine Traditional Name: 1,3-dithiolan-2-ylmethyl-[6-(4-methoxyphenyl)-5-phenyl-furo[2,3-d]pyrimidin-4-yl]amine Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=C(N=CN=C3O2)NCC4SCCS4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=C(N=CN=C3O2)NCC4SCCS4)C5=CC=CC=C5

InChI

InChI=1S/C23H21N3O2S2/c1-27-17-9-7-16(8-10-17)21-19(15-5-3-2-4-6-15)20-22(25-14-26-23(20)28-21)24-13-18-29-11-12-30-18/h2-10,14,18H,11-13H2,1H3,(H,24,25,26)