N-[4-[2-(4-methylphenyl)ethylcarbamothioylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[2-(4-methylphenyl)ethylcarbamothioylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[2-(p-tolyl)ethylcarbamothioylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[[2-(4-methylphenyl)ethylamino]-sulfanylidenemethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[2-(4-methylphenyl)ethylcarbamothioylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[2-(p-tolyl)ethylthiocarbamoylamino]phenyl]-2-furamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)CCNC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H21N3O2S/c1-15-4-6-16(7-5-15)12-13-22-21(27)24-18-10-8-17(9-11-18)23-20(25)19-3-2-14-26-19/h2-11,14H,12-13H2,1H3,(H,23,25)(H2,22,24,27)