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

Systemtic Name: 7-methyl-2-phenacylsulfanyl-3-(phenylmethyl)-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one Openeye Name: 3-benzyl-7-methyl-2-phenacylsulfanyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one CAS Name: 7-methyl-2-(phenacylthio)-3-(phenylmethyl)-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one IUPAC Name: 3-benzyl-7-methyl-2-phenacylsulfanyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one Traditional Name: 3-benzyl-7-methyl-2-(phenacylthio)-5,6,7,8-tetrahydrothiochromen[2,3-d]imidazol-9-one Formula: C26H24N2O2S2 MolecularWeight: 460.61096

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=O)C3=C(S2)N(C(=N3)SCC(=O)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1CCC2=C(C1)C(=O)C3=C(S2)N(C(=N3)SCC(=O)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H24N2O2S2/c1-17-12-13-22-20(14-17)24(30)23-25(32-22)28(15-18-8-4-2-5-9-18)26(27-23)31-16-21(29)19-10-6-3-7-11-19/h2-11,17H,12-16H2,1H3