N-[3-[[(3,4-dichlorophenyl)carbamothioylamino]carbamoyl]phenyl]-5-thiophen-2-yl-pentanamide

Systemtic Name: N-[3-[[(3,4-dichlorophenyl)carbamothioylamino]carbamoyl]phenyl]-5-thiophen-2-yl-pentanamide Openeye Name: N-[3-[[(3,4-dichlorophenyl)carbamothioylamino]carbamoyl]phenyl]-5-(2-thienyl)pentanamide CAS Name: N-[3-[[[(3,4-dichloroanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-5-thiophen-2-ylpentanamide IUPAC Name: N-[3-[[(3,4-dichlorophenyl)carbamothioylamino]carbamoyl]phenyl]-5-thiophen-2-ylpentanamide Traditional Name: N-[3-[[(3,4-dichlorophenyl)thiocarbamoylamino]carbamoyl]phenyl]-5-(2-thienyl)valeramide Formula: C23H22Cl2N4O2S2 MolecularWeight: 521.48238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCCC2=CC=CS2)C(=O)NNC(=S)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCCC2=CC=CS2)C(=O)NNC(=S)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H22Cl2N4O2S2/c24-19-11-10-17(14-20(19)25)27-23(32)29-28-22(31)15-5-3-6-16(13-15)26-21(30)9-2-1-7-18-8-4-12-33-18/h3-6,8,10-14H,1-2,7,9H2,(H,26,30)(H,28,31)(H2,27,29,32)