N-[4-[[4-butoxy-3,5-bis(chloranyl)phenyl]carbamothioylamino]phenyl]ethanamide

Systemtic Name: N-[4-[[4-butoxy-3,5-bis(chloranyl)phenyl]carbamothioylamino]phenyl]ethanamide Openeye Name: N-[4-[(4-butoxy-3,5-dichloro-phenyl)carbamothioylamino]phenyl]acetamide CAS Name: N-[4-[[(4-butoxy-3,5-dichloroanilino)-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-[(4-butoxy-3,5-dichlorophenyl)carbamothioylamino]phenyl]acetamide Traditional Name: N-[4-[(4-butoxy-3,5-dichloro-phenyl)thiocarbamoylamino]phenyl]acetamide Formula: C19H21Cl2N3O2S MolecularWeight: 426.35994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)NC(=S)NC2=CC=C(C=C2)NC(=O)C)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)NC(=S)NC2=CC=C(C=C2)NC(=O)C)Cl

InChI

InChI=1S/C19H21Cl2N3O2S/c1-3-4-9-26-18-16(20)10-15(11-17(18)21)24-19(27)23-14-7-5-13(6-8-14)22-12(2)25/h5-8,10-11H,3-4,9H2,1-2H3,(H,22,25)(H2,23,24,27)