1-[2-[3-(2,5-diethylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethyl]-3-methyl-thiourea

Systemtic Name: 1-[2-[3-(2,5-diethylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethyl]-3-methyl-thiourea Openeye Name: 1-[2-[3-(2,5-diethylphenyl)-4,5-dihydroisoxazol-5-yl]ethyl]-3-methyl-thiourea CAS Name: 1-[2-[3-(2,5-diethylphenyl)-4,5-dihydroisoxazol-5-yl]ethyl]-3-methylthiourea IUPAC Name: 1-[2-[3-(2,5-diethylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]ethyl]-3-methylthiourea Traditional Name: 1-[2-[3-(2,5-diethylphenyl)-2-isoxazolin-5-yl]ethyl]-3-methyl-thiourea Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C2=NOC(C2)CCNC(=S)NC

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C2=NOC(C2)CCNC(=S)NC

InChI

InChI=1S/C17H25N3OS/c1-4-12-6-7-13(5-2)15(10-12)16-11-14(21-20-16)8-9-19-17(22)18-3/h6-7,10,14H,4-5,8-9,11H2,1-3H3,(H2,18,19,22)