1-(phenylmethyl)-3-[4-[[(phenylmethyl)carbamothioylamino]carbamoyl]phenyl]thiourea

Systemtic Name: 1-(phenylmethyl)-3-[4-[[(phenylmethyl)carbamothioylamino]carbamoyl]phenyl]thiourea Openeye Name: 1-benzyl-3-[[4-(benzylcarbamothioylamino)benzoyl]amino]thiourea CAS Name: 1-[[oxo-[4-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]phenyl]methyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[4-(benzylcarbamothioylamino)benzoyl]amino]thiourea Traditional Name: 1-benzyl-3-[[4-(benzylthiocarbamoylamino)benzoyl]amino]thiourea Formula: C23H23N5OS2 MolecularWeight: 449.59162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)C(=O)NNC(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)C(=O)NNC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C23H23N5OS2/c29-21(27-28-23(31)25-16-18-9-5-2-6-10-18)19-11-13-20(14-12-19)26-22(30)24-15-17-7-3-1-4-8-17/h1-14H,15-16H2,(H,27,29)(H2,24,26,30)(H2,25,28,31)