1-[(3-bromanyl-4-methoxy-phenyl)methyl]-3-(pyridin-3-ylcarbonylamino)thiourea

Systemtic Name: 1-[(3-bromanyl-4-methoxy-phenyl)methyl]-3-(pyridin-3-ylcarbonylamino)thiourea Openeye Name: 1-[(3-bromo-4-methoxy-phenyl)methyl]-3-(pyridine-3-carbonylamino)thiourea CAS Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-3-[[oxo(3-pyridinyl)methyl]amino]thiourea IUPAC Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-3-(pyridine-3-carbonylamino)thiourea Traditional Name: 1-(3-bromo-4-methoxy-benzyl)-3-nicotinamido-thiourea Formula: C15H15BrN4O2S MolecularWeight: 395.2742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=S)NNC(=O)C2=CN=CC=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=S)NNC(=O)C2=CN=CC=C2)Br

InChI

InChI=1S/C15H15BrN4O2S/c1-22-13-5-4-10(7-12(13)16)8-18-15(23)20-19-14(21)11-3-2-6-17-9-11/h2-7,9H,8H2,1H3,(H,19,21)(H2,18,20,23)