N-[2-[(2,4-dimethylphenyl)carbamothioylamino]ethyl]-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[2-[(2,4-dimethylphenyl)carbamothioylamino]ethyl]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[2-[(2,4-dimethylphenyl)carbamothioylamino]ethyl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[2-[[(2,4-dimethylanilino)-sulfanylidenemethyl]amino]ethyl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[2-[(2,4-dimethylphenyl)carbamothioylamino]ethyl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[2-[(2,4-dimethylphenyl)thiocarbamoylamino]ethyl]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NCCNC(=O)C2=NN(C(=C2)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NCCNC(=O)C2=NN(C(=C2)C)C)C

InChI

InChI=1S/C17H23N5OS/c1-11-5-6-14(12(2)9-11)20-17(24)19-8-7-18-16(23)15-10-13(3)22(4)21-15/h5-6,9-10H,7-8H2,1-4H3,(H,18,23)(H2,19,20,24)