2-[(4-butylphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[[(4-butylanilino)-sulfanylidenemethyl]amino]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[(4-butylphenyl)thiocarbamoylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC(=O)NC2=C(N(N=C2C)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC(=O)NC2=C(N(N=C2C)C)C

InChI

InChI=1S/C19H27N5OS/c1-5-6-7-15-8-10-16(11-9-15)21-19(26)20-12-17(25)22-18-13(2)23-24(4)14(18)3/h8-11H,5-7,12H2,1-4H3,(H,22,25)(H2,20,21,26)