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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=CC=C(C=C3)NC(=S)NC4=CC=CC=C4

InChI

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