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

Systemtic Name: 1-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[3-(4-bromo-1-pyrazolyl)propyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[3-(4-bromopyrazol-1-yl)propyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C17H17BrN4O2S MolecularWeight: 421.31148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NCCCN3C=C(C=N3)Br

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C17H17BrN4O2S/c1-11-7-16(23)24-15-8-13(3-4-14(11)15)21-17(25)19-5-2-6-22-10-12(18)9-20-22/h3-4,7-10H,2,5-6H2,1H3,(H2,19,21,25)