3-chloranyl-N-[3-[1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]benzamide

Systemtic Name: 3-chloranyl-N-[3-[1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]benzamide Openeye Name: 3-chloro-N-[3-[1-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]propylsulfanyl]phenyl]benzamide CAS Name: 3-chloro-N-[3-[[1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]thio]phenyl]benzamide IUPAC Name: 3-chloro-N-[3-[1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl]sulfanylphenyl]benzamide Traditional Name: 3-chloro-N-[3-[1-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]propylthio]phenyl]benzamide Formula: C25H22ClN3O3S2 MolecularWeight: 512.04348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H22ClN3O3S2/c1-3-21(24(31)29-25-28-20-11-10-18(32-2)14-22(20)34-25)33-19-9-5-8-17(13-19)27-23(30)15-6-4-7-16(26)12-15/h4-14,21H,3H2,1-2H3,(H,27,30)(H,28,29,31)