2-[(4-butylphenyl)carbamothioylamino]-N-(3-chloranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(3-chloranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(3-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[[(4-butylanilino)-sulfanylidenemethyl]amino]-N-(3-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[(4-butylphenyl)carbamothioylamino]-N-(3-chloro-2-methylphenyl)acetamide Traditional Name: 2-[(4-butylphenyl)thiocarbamoylamino]-N-(3-chloro-2-methyl-phenyl)acetamide Formula: C20H24ClN3OS MolecularWeight: 389.94206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC(=O)NC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC(=O)NC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C20H24ClN3OS/c1-3-4-6-15-9-11-16(12-10-15)23-20(26)22-13-19(25)24-18-8-5-7-17(21)14(18)2/h5,7-12H,3-4,6,13H2,1-2H3,(H,24,25)(H2,22,23,26)