N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-1-phenyl-ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[4-[[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-1-phenylethyl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-1-phenylethyl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-keto-2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-phenyl-ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C29H29N3O3S2 MolecularWeight: 531.68886

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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(=O)C5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C3=CC=CC=C3)SC4=CC=C(C=C4)NC(=O)C5CCCCC5

InChI

InChI=1S/C29H29N3O3S2/c1-35-22-14-17-24-25(18-22)37-29(31-24)32-28(34)26(19-8-4-2-5-9-19)36-23-15-12-21(13-16-23)30-27(33)20-10-6-3-7-11-20/h2,4-5,8-9,12-18,20,26H,3,6-7,10-11H2,1H3,(H,30,33)(H,31,32,34)