1-methyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]thiourea

Systemtic Name: 1-methyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]thiourea Openeye Name: 1-methyl-3-[(3-phenylisoxazol-5-yl)methyl]thiourea CAS Name: 1-methyl-3-[(3-phenyl-5-isoxazolyl)methyl]thiourea IUPAC Name: 1-methyl-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]thiourea Traditional Name: 1-methyl-3-[(3-phenylisoxazol-5-yl)methyl]thiourea Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCC1=CC(=NO1)C2=CC=CC=C2

Isomeric SMILES

CNC(=S)NCC1=CC(=NO1)C2=CC=CC=C2

InChI

InChI=1S/C12H13N3OS/c1-13-12(17)14-8-10-7-11(15-16-10)9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H2,13,14,17)