N-[3-[3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]phenyl]pentanamide

Systemtic Name: N-[3-[3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]phenyl]pentanamide Openeye Name: N-[3-[3-[5-(4-chlorophenyl)-2-furyl]prop-2-enoylcarbamothioylamino]phenyl]pentanamide CAS Name: N-[3-[[[[3-[5-(4-chlorophenyl)-2-furanyl]-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]pentanamide IUPAC Name: N-[3-[3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]phenyl]pentanamide Traditional Name: N-[3-[[3-[5-(4-chlorophenyl)-2-furyl]acryloyl]thiocarbamoylamino]phenyl]valeramide Formula: C25H24ClN3O3S MolecularWeight: 481.99436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H24ClN3O3S/c1-2-3-7-23(30)27-19-5-4-6-20(16-19)28-25(33)29-24(31)15-13-21-12-14-22(32-21)17-8-10-18(26)11-9-17/h4-6,8-16H,2-3,7H2,1H3,(H,27,30)(H2,28,29,31,33)