2-[2-[(phenylcarbamothioylamino)methyl]phenyl]-N-(2-pyridin-2-ylethyl)benzamide

Systemtic Name: 2-[2-[(phenylcarbamothioylamino)methyl]phenyl]-N-(2-pyridin-2-ylethyl)benzamide Openeye Name: 2-[2-[(phenylcarbamothioylamino)methyl]phenyl]-N-[2-(2-pyridyl)ethyl]benzamide CAS Name: 2-[2-[[[anilino(sulfanylidene)methyl]amino]methyl]phenyl]-N-[2-(2-pyridinyl)ethyl]benzamide IUPAC Name: 2-[2-[(phenylcarbamothioylamino)methyl]phenyl]-N-(2-pyridin-2-ylethyl)benzamide Traditional Name: 2-[2-[(phenylthiocarbamoylamino)methyl]phenyl]-N-[2-(2-pyridyl)ethyl]benzamide Formula: C28H26N4OS MolecularWeight: 466.59724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2C3=CC=CC=C3C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2C3=CC=CC=C3C(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C28H26N4OS/c33-27(30-19-17-22-11-8-9-18-29-22)26-16-7-6-15-25(26)24-14-5-4-10-21(24)20-31-28(34)32-23-12-2-1-3-13-23/h1-16,18H,17,19-20H2,(H,30,33)(H2,31,32,34)