1-[4-(1-adamantylsulfamoyl)phenyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea

Systemtic Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[4-(1-adamantylsulfamoyl)phenyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C27H29N3O4S2 MolecularWeight: 523.66686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H29N3O4S2/c1-16-8-25(31)34-24-12-21(4-7-23(16)24)29-26(35)28-20-2-5-22(6-3-20)36(32,33)30-27-13-17-9-18(14-27)11-19(10-17)15-27/h2-8,12,17-19,30H,9-11,13-15H2,1H3,(H2,28,29,35)