1-[1-(1-adamantyl)propyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea

Systemtic Name: 1-[1-(1-adamantyl)propyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[1-(1-adamantyl)propyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[1-(1-adamantyl)propyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[1-(1-adamantyl)propyl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[1-(1-adamantyl)propyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C24H30N2O2S MolecularWeight: 410.5722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC5=C(C=C4)C(=CC(=O)O5)C

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC4=CC5=C(C=C4)C(=CC(=O)O5)C

InChI

InChI=1S/C24H30N2O2S/c1-3-21(24-11-15-7-16(12-24)9-17(8-15)13-24)26-23(29)25-18-4-5-19-14(2)6-22(27)28-20(19)10-18/h4-6,10,15-17,21H,3,7-9,11-13H2,1-2H3,(H2,25,26,29)