N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C24H22N4O2S3 MolecularWeight: 494.65208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C24H22N4O2S3/c1-2-30-18-10-13-20-21(14-18)33-24(27-20)28-22(29)15-32-19-11-8-17(9-12-19)26-23(31)25-16-6-4-3-5-7-16/h3-14H,2,15H2,1H3,(H2,25,26,31)(H,27,28,29)