1-[(7-bromanyl-5-fluoranyl-2-oxidanylidene-indol-3-yl)amino]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[(7-bromanyl-5-fluoranyl-2-oxidanylidene-indol-3-yl)amino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[(7-bromo-5-fluoro-2-oxo-indol-3-yl)amino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[(7-bromo-5-fluoro-2-oxo-3-indolyl)amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[(7-bromo-5-fluoro-2-oxoindol-3-yl)amino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[(7-bromo-5-fluoro-2-keto-indol-3-yl)amino]-3-(3-methoxyphenyl)thiourea Formula: C16H12BrFN4O2S MolecularWeight: 423.259483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NNC2=C3C=C(C=C(C3=NC2=O)Br)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NNC2=C3C=C(C=C(C3=NC2=O)Br)F

InChI

InChI=1S/C16H12BrFN4O2S/c1-24-10-4-2-3-9(7-10)19-16(25)22-21-14-11-5-8(18)6-12(17)13(11)20-15(14)23/h2-7H,1H3,(H2,19,22,25)(H,20,21,23)