N-[4-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[4-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[4-[[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C22H23N3O2S2 MolecularWeight: 425.56692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H23N3O2S2/c26-20(25-22-24-18-8-4-5-9-19(18)29-22)14-28-17-12-10-16(11-13-17)23-21(27)15-6-2-1-3-7-15/h4-5,8-13,15H,1-3,6-7,14H2,(H,23,27)(H,24,25,26)