2-[(4-butylphenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[(4-butylanilino)-sulfanylidenemethyl]amino]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[(4-butylphenyl)thiocarbamoylamino]-N-(2,6-dimethylphenyl)acetamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3OS/c1-4-5-9-17-10-12-18(13-11-17)23-21(26)22-14-19(25)24-20-15(2)7-6-8-16(20)3/h6-8,10-13H,4-5,9,14H2,1-3H3,(H,24,25)(H2,22,23,26)