1-[4-bromanyl-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea

Systemtic Name: 1-[4-bromanyl-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]-3-pyrazolyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[4-bromo-1-(4-chlorobenzyl)pyrazol-3-yl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C21H16BrClN4O2S MolecularWeight: 503.79934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=NN(C=C3Br)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=NN(C=C3Br)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16BrClN4O2S/c1-12-8-19(28)29-18-9-15(6-7-16(12)18)24-21(30)25-20-17(22)11-27(26-20)10-13-2-4-14(23)5-3-13/h2-9,11H,10H2,1H3,(H2,24,25,26,30)