1-(3,5-dimethylphenyl)-3-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]thiourea Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC(=O)COC2=CC3=C(C=C2)C(=CC(=O)O3)C)C

InChI

InChI=1S/C21H21N3O4S/c1-12-6-13(2)8-15(7-12)22-21(29)24-23-19(25)11-27-16-4-5-17-14(3)9-20(26)28-18(17)10-16/h4-10H,11H2,1-3H3,(H,23,25)(H2,22,24,29)