pentyl 2-[(diphenylmethyl)carbamothioylamino]ethanoate

Systemtic Name: pentyl 2-[(diphenylmethyl)carbamothioylamino]ethanoate Openeye Name: pentyl 2-(benzhydrylcarbamothioylamino)acetate CAS Name: 2-[[[(diphenylmethyl)amino]-sulfanylidenemethyl]amino]acetic acid pentyl ester IUPAC Name: pentyl 2-(benzhydrylcarbamothioylamino)acetate Traditional Name: 2-(benzhydrylthiocarbamoylamino)acetic acid amyl ester Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CNC(=S)NC(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCOC(=O)CNC(=S)NC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-2-3-10-15-25-19(24)16-22-21(26)23-20(17-11-6-4-7-12-17)18-13-8-5-9-14-18/h4-9,11-14,20H,2-3,10,15-16H2,1H3,(H2,22,23,26)