N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-[(2S)-butan-2-yl]oxy-benzamide

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-[(2S)-butan-2-yl]oxy-benzamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-[(1S)-1-methylpropoxy]benzamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-4-[(2S)-butan-2-yl]oxybenzamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-4-[(2S)-butan-2-yl]oxybenzamide Traditional Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-4-[(1S)-1-methylpropoxy]benzamide Formula: C25H23N3O2S2 MolecularWeight: 461.59902

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC[C@H](C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

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