3-chloranyl-N-[4-[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]benzamide

Systemtic Name: 3-chloranyl-N-[4-[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]benzamide Openeye Name: 3-chloro-N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1-methyl-2-oxo-ethyl]sulfanylphenyl]benzamide CAS Name: 3-chloro-N-[4-[[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]thio]phenyl]benzamide IUPAC Name: 3-chloro-N-[4-[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]sulfanylphenyl]benzamide Traditional Name: 3-chloro-N-[4-[[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-keto-1-methyl-ethyl]thio]phenyl]benzamide Formula: C25H22ClN3O3S2 MolecularWeight: 512.04348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

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