1-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea

Systemtic Name: 1-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[3,3-dimethyl-1-(1-pyrazolyl)butan-2-yl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-(3,3-dimethyl-1-pyrazol-1-ylbutan-2-yl)-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC(CN3C=CC=N3)C(C)(C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC(CN3C=CC=N3)C(C)(C)C

InChI

InChI=1S/C20H24N4O2S/c1-13-10-18(25)26-16-11-14(6-7-15(13)16)22-19(27)23-17(20(2,3)4)12-24-9-5-8-21-24/h5-11,17H,12H2,1-4H3,(H2,22,23,27)