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

Systemtic Name: 4-tert-butyl-N-[4-[3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[3-[5-(4-chlorophenyl)-2-furyl]prop-2-enoylcarbamothioylamino]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[[[[3-[5-(4-chlorophenyl)-2-furanyl]-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enoylcarbamothioylamino]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[[3-[5-(4-chlorophenyl)-2-furyl]acryloyl]thiocarbamoylamino]phenyl]benzamide Formula: C31H28ClN3O3S MolecularWeight: 558.09032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(O3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C31H28ClN3O3S/c1-31(2,3)22-8-4-21(5-9-22)29(37)33-24-12-14-25(15-13-24)34-30(39)35-28(36)19-17-26-16-18-27(38-26)20-6-10-23(32)11-7-20/h4-19H,1-3H3,(H,33,37)(H2,34,35,36,39)