3-butoxy-N-[[4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]phenyl]thiocarbamoyl]benzamide Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CC3=C(NN=C3C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CC3=C(NN=C3C)C

InChI

InChI=1S/C24H28N4O2S/c1-4-5-13-30-21-8-6-7-19(15-21)23(29)26-24(31)25-20-11-9-18(10-12-20)14-22-16(2)27-28-17(22)3/h6-12,15H,4-5,13-14H2,1-3H3,(H,27,28)(H2,25,26,29,31)