1-(2-bromophenyl)-3-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-(2-bromophenyl)-3-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-(2-bromophenyl)-3-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]thiourea CAS Name: 1-(2-bromophenyl)-3-[1-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-(2-bromophenyl)-3-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-(2-bromophenyl)-3-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]thiourea Formula: C16H16BrN5OS MolecularWeight: 406.30014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=S)NC3=CC=CC=C3Br

Isomeric SMILES

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=S)NC3=CC=CC=C3Br

InChI

InChI=1S/C16H16BrN5OS/c1-10-13(11(2)23-21-10)9-22-8-12(7-18-22)19-16(24)20-15-6-4-3-5-14(15)17/h3-8H,9H2,1-2H3,(H2,19,20,24)