methyl 2-[[3-(5-oxidanylidene-2H-1,2,4-thiadiazol-3-yl)-4-phenyl-phenyl]methyl-pentanoyl-amino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[3-(5-oxidanylidene-2H-1,2,4-thiadiazol-3-yl)-4-phenyl-phenyl]methyl-pentanoyl-amino]thiophene-3-carboxylate Openeye Name: methyl 2-[[3-(5-oxo-2H-1,2,4-thiadiazol-3-yl)-4-phenyl-phenyl]methyl-pentanoyl-amino]thiophene-3-carboxylate CAS Name: 2-[1-oxopentyl-[[3-(5-oxo-2H-1,2,4-thiadiazol-3-yl)-4-phenylphenyl]methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-(5-oxo-2H-1,2,4-thiadiazol-3-yl)-4-phenylphenyl]methyl-pentanoylamino]thiophene-3-carboxylate Traditional Name: 2-[[3-(5-keto-2H-1,2,4-thiadiazol-3-yl)-4-phenyl-benzyl]-valeryl-amino]thiophene-3-carboxylic acid methyl ester Formula: C26H25N3O4S2 MolecularWeight: 507.6244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC(=C(C=C1)C2=CC=CC=C2)C3=NC(=O)SN3)C4=C(C=CS4)C(=O)OC

Isomeric SMILES

CCCCC(=O)N(CC1=CC(=C(C=C1)C2=CC=CC=C2)C3=NC(=O)SN3)C4=C(C=CS4)C(=O)OC

InChI

InChI=1S/C26H25N3O4S2/c1-3-4-10-22(30)29(24-20(13-14-34-24)25(31)33-2)16-17-11-12-19(18-8-6-5-7-9-18)21(15-17)23-27-26(32)35-28-23/h5-9,11-15H,3-4,10,16H2,1-2H3,(H,27,28,32)