3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(diphenylmethyl)carbamothioyl]propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(diphenylmethyl)carbamothioyl]propanamide Openeye Name: N-(benzhydrylcarbamothioyl)-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[[(diphenylmethyl)amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-(benzhydrylcarbamothioyl)-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(benzhydrylthiocarbamoyl)-3-phthalimido-propionamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=S)NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=S)NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21N3O3S/c29-21(15-16-28-23(30)19-13-7-8-14-20(19)24(28)31)26-25(32)27-22(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-14,22H,15-16H2,(H2,26,27,29,32)