(2-hydroxyphenyl)methyl-bis[2-(phenylcarbamothioylamino)ethyl]azanium

Systemtic Name: (2-hydroxyphenyl)methyl-bis[2-(phenylcarbamothioylamino)ethyl]azanium Openeye Name: (2-hydroxyphenyl)methyl-bis[2-(phenylcarbamothioylamino)ethyl]ammonium CAS Name: bis[2-[[anilino(sulfanylidene)methyl]amino]ethyl]-[(2-hydroxyphenyl)methyl]ammonium IUPAC Name: (2-hydroxyphenyl)methyl-bis[2-(phenylcarbamothioylamino)ethyl]azanium Traditional Name: bis[2-(phenylthiocarbamoylamino)ethyl]-salicyl-ammonium Formula: C25H30N5OS2+ MolecularWeight: 480.6686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCC[NH+](CCNC(=S)NC2=CC=CC=C2)CC3=CC=CC=C3O

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCC[NH+](CCNC(=S)NC2=CC=CC=C2)CC3=CC=CC=C3O

InChI

InChI=1S/C25H29N5OS2/c31-23-14-8-7-9-20(23)19-30(17-15-26-24(32)28-21-10-3-1-4-11-21)18-16-27-25(33)29-22-12-5-2-6-13-22/h1-14,31H,15-19H2,(H2,26,28,32)(H2,27,29,33)/p+1