1-(3,5-dimethyl-4-oxidanyl-phenyl)-3-(4-phenyl-1H-isothiochromen-3-yl)urea

Systemtic Name: 1-(3,5-dimethyl-4-oxidanyl-phenyl)-3-(4-phenyl-1H-isothiochromen-3-yl)urea Openeye Name: 1-(4-hydroxy-3,5-dimethyl-phenyl)-3-(4-phenyl-1H-isothiochromen-3-yl)urea CAS Name: 1-(4-hydroxy-3,5-dimethylphenyl)-3-(4-phenyl-1H-2-benzothiopyran-3-yl)urea IUPAC Name: 1-(4-hydroxy-3,5-dimethylphenyl)-3-(4-phenyl-1H-isothiochromen-3-yl)urea Traditional Name: 1-(4-hydroxy-3,5-dimethyl-phenyl)-3-(4-phenyl-1H-isothiochromen-3-yl)urea Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)NC(=O)NC2=C(C3=CC=CC=C3CS2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1O)C)NC(=O)NC2=C(C3=CC=CC=C3CS2)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O2S/c1-15-12-19(13-16(2)22(15)27)25-24(28)26-23-21(17-8-4-3-5-9-17)20-11-7-6-10-18(20)14-29-23/h3-13,27H,14H2,1-2H3,(H2,25,26,28)