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

Systemtic Name: 1-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]thiourea CAS Name: 1-[1-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]thiourea Formula: C13H17N5OS MolecularWeight: 291.37198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=S)NCC=C

Isomeric SMILES

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=S)NCC=C

InChI

InChI=1S/C13H17N5OS/c1-4-5-14-13(20)16-11-6-15-18(7-11)8-12-9(2)17-19-10(12)3/h4,6-7H,1,5,8H2,2-3H3,(H2,14,16,20)