6-tert-butyl-2-phenacylsulfanyl-3-(phenylmethyl)-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one

Systemtic Name: 6-tert-butyl-2-phenacylsulfanyl-3-(phenylmethyl)-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one Openeye Name: 3-benzyl-6-tert-butyl-2-phenacylsulfanyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one CAS Name: 6-tert-butyl-2-(phenacylthio)-3-(phenylmethyl)-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one IUPAC Name: 3-benzyl-6-tert-butyl-2-phenacylsulfanyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one Traditional Name: 3-benzyl-6-tert-butyl-2-(phenacylthio)-5,6,7,8-tetrahydrothiochromen[2,3-d]imidazol-9-one Formula: C29H30N2O2S2 MolecularWeight: 502.6907

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC3=C(C2=O)N=C(N3CC4=CC=CC=C4)SCC(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC3=C(C2=O)N=C(N3CC4=CC=CC=C4)SCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H30N2O2S2/c1-29(2,3)21-14-15-22-24(16-21)35-27-25(26(22)33)30-28(31(27)17-19-10-6-4-7-11-19)34-18-23(32)20-12-8-5-9-13-20/h4-13,21H,14-18H2,1-3H3