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

Systemtic Name: 1-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-(4-methyl-2-oxidanylidene-chromen-7-yl)thiourea Openeye Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(4-methyl-2-oxo-chromen-7-yl)thiourea CAS Name: 1-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-3-(4-methyl-2-oxo-1-benzopyran-7-yl)thiourea IUPAC Name: 1-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-3-(4-methyl-2-oxochromen-7-yl)thiourea Traditional Name: 1-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(2-keto-4-methyl-chromen-7-yl)thiourea Formula: C18H19BrN4O2S MolecularWeight: 435.33806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN4O2S/c1-11-8-17(24)25-16-9-13(4-5-14(11)16)21-18(26)20-6-3-7-23-10-15(19)12(2)22-23/h4-5,8-10H,3,6-7H2,1-2H3,(H2,20,21,26)