N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: 4-isopropoxy-N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]benzamide CAS Name: N-[[(2-phenyl-1,3-benzoxazol-5-yl)amino]-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: 4-isopropoxy-N-[(2-phenyl-1,3-benzoxazol-5-yl)thiocarbamoyl]benzamide Formula: C24H21N3O3S MolecularWeight: 431.50684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3S/c1-15(2)29-19-11-8-16(9-12-19)22(28)27-24(31)25-18-10-13-21-20(14-18)26-23(30-21)17-6-4-3-5-7-17/h3-15H,1-2H3,(H2,25,27,28,31)