4-tert-butyl-N-[(2-oxidanylidenechromen-6-yl)carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[(2-oxidanylidenechromen-6-yl)carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[(2-oxochromen-6-yl)carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[(2-oxo-1-benzopyran-6-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[(2-oxochromen-6-yl)carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[(2-ketochromen-6-yl)thiocarbamoyl]benzamide Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=O)C=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=O)C=C3

InChI

InChI=1S/C21H20N2O3S/c1-21(2,3)15-7-4-13(5-8-15)19(25)23-20(27)22-16-9-10-17-14(12-16)6-11-18(24)26-17/h4-12H,1-3H3,(H2,22,23,25,27)