1-(1,2-oxazol-3-yl)-3-phenethyl-thiourea

Systemtic Name: 1-(1,2-oxazol-3-yl)-3-phenethyl-thiourea Openeye Name: 1-isoxazol-3-yl-3-phenethyl-thiourea CAS Name: 1-(3-isoxazolyl)-3-phenethylthiourea IUPAC Name: 1-(1,2-oxazol-3-yl)-3-phenethylthiourea Traditional Name: 1-isoxazol-3-yl-3-phenethyl-thiourea Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2=NOC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2=NOC=C2

InChI

InChI=1S/C12H13N3OS/c17-12(14-11-7-9-16-15-11)13-8-6-10-4-2-1-3-5-10/h1-5,7,9H,6,8H2,(H2,13,14,15,17)