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

Systemtic Name: 1-[(1,3-dimethylpyrazol-4-yl)methyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[(1,3-dimethylpyrazol-4-yl)methyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[(1,3-dimethyl-4-pyrazolyl)methyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[(1,3-dimethylpyrazol-4-yl)methyl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[(1,3-dimethylpyrazol-4-yl)methyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NCC3=CN(N=C3C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NCC3=CN(N=C3C)C

InChI

InChI=1S/C17H18N4O2S/c1-10-6-16(22)23-15-7-13(4-5-14(10)15)19-17(24)18-8-12-9-21(3)20-11(12)2/h4-7,9H,8H2,1-3H3,(H2,18,19,24)