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

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C23H20N4O2S3 MolecularWeight: 480.6255

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2S3/c1-29-17-9-12-19-20(13-17)32-23(26-19)27-21(28)14-31-18-10-7-16(8-11-18)25-22(30)24-15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H2,24,25,30)(H,26,27,28)