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

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-phenylacetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-phenyl-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C29H24N4O2S3 MolecularWeight: 556.72146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

InChI

InChI=1S/C29H24N4O2S3/c1-35-22-14-17-24-25(18-22)38-29(32-24)33-27(34)26(19-8-4-2-5-9-19)37-23-15-12-21(13-16-23)31-28(36)30-20-10-6-3-7-11-20/h2-18,26H,1H3,(H2,30,31,36)(H,32,33,34)