1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-[3-(5-methylpyrazol-1-yl)propyl]thiourea

Systemtic Name: 1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-[3-(5-methylpyrazol-1-yl)propyl]thiourea Openeye Name: 1-(4-methyl-2-oxo-chromen-7-yl)-3-[3-(5-methylpyrazol-1-yl)propyl]thiourea CAS Name: 1-(4-methyl-2-oxo-1-benzopyran-7-yl)-3-[3-(5-methyl-1-pyrazolyl)propyl]thiourea IUPAC Name: 1-(4-methyl-2-oxochromen-7-yl)-3-[3-(5-methylpyrazol-1-yl)propyl]thiourea Traditional Name: 1-(2-keto-4-methyl-chromen-7-yl)-3-[3-(5-methylpyrazol-1-yl)propyl]thiourea Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CCCNC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C

Isomeric SMILES

CC1=CC=NN1CCCNC(=S)NC2=CC3=C(C=C2)C(=CC(=O)O3)C

InChI

InChI=1S/C18H20N4O2S/c1-12-10-17(23)24-16-11-14(4-5-15(12)16)21-18(25)19-7-3-9-22-13(2)6-8-20-22/h4-6,8,10-11H,3,7,9H2,1-2H3,(H2,19,21,25)