2-(3-methylbutylsulfanyl)-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one

Systemtic Name: 2-(3-methylbutylsulfanyl)-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one Openeye Name: 2-isopentylsulfanyl-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one CAS Name: 2-(3-methylbutylthio)-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one IUPAC Name: 2-(3-methylbutylsulfanyl)-3-phenyl-5,6,7,8-tetrahydrothiochromeno[2,3-d]imidazol-9-one Traditional Name: 2-(isoamylthio)-3-phenyl-5,6,7,8-tetrahydrothiochromen[2,3-d]imidazol-9-one Formula: C21H24N2OS2 MolecularWeight: 384.55806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC2=C(N1C3=CC=CC=C3)SC4=C(C2=O)CCCC4

Isomeric SMILES

CC(C)CCSC1=NC2=C(N1C3=CC=CC=C3)SC4=C(C2=O)CCCC4

InChI

InChI=1S/C21H24N2OS2/c1-14(2)12-13-25-21-22-18-19(24)16-10-6-7-11-17(16)26-20(18)23(21)15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13H2,1-2H3