4-decoxy-N-[2-[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 4-decoxy-N-[2-[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: N-[2-[2-(4-acetylanilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-decoxy-benzamide CAS Name: N-[2-[[2-(4-acetylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-4-decoxybenzamide IUPAC Name: N-[2-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-decoxybenzamide Traditional Name: N-[2-[[2-(4-acetylanilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]-4-decoxy-benzamide Formula: C34H39N3O4S2 MolecularWeight: 617.82116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NC4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C34H39N3O4S2/c1-3-4-5-6-7-8-9-10-21-41-29-18-13-26(14-19-29)33(40)36-28-17-20-30-31(22-28)43-34(37-30)42-23-32(39)35-27-15-11-25(12-16-27)24(2)38/h11-20,22H,3-10,21,23H2,1-2H3,(H,35,39)(H,36,40)