4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-prop-2-enyl-piperazine-1-carbothioamide

Systemtic Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-prop-2-enyl-piperazine-1-carbothioamide Openeye Name: N-allyl-4-(3,5-dimethylisoxazol-4-yl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-prop-2-enyl-1-piperazinecarbothioamide IUPAC Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-prop-2-enylpiperazine-1-carbothioamide Traditional Name: N-allyl-4-(3,5-dimethylisoxazol-4-yl)sulfonyl-piperazine-1-carbothioamide Formula: C13H20N4O3S2 MolecularWeight: 344.4529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=S)NCC=C

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=S)NCC=C

InChI

InChI=1S/C13H20N4O3S2/c1-4-5-14-13(21)16-6-8-17(9-7-16)22(18,19)12-10(2)15-20-11(12)3/h4H,1,5-9H2,2-3H3,(H,14,21)