N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-[(2S)-butan-2-yl]oxy-benzamide

Systemtic Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-[(2S)-butan-2-yl]oxy-benzamide Openeye Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-[(1S)-1-methylpropoxy]benzamide CAS Name: N-[[2-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-3-[(2S)-butan-2-yl]oxybenzamide IUPAC Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-[(2S)-butan-2-yl]oxybenzamide Traditional Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-3-[(1S)-1-methylpropoxy]benzamide Formula: C25H23N3O2S2 MolecularWeight: 461.59902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC[C@H](C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H23N3O2S2/c1-3-16(2)30-18-10-8-9-17(15-18)23(29)28-25(31)27-20-12-5-4-11-19(20)24-26-21-13-6-7-14-22(21)32-24/h4-16H,3H2,1-2H3,(H2,27,28,29,31)/t16-/m0/s1