N-[1-[4-ethyl-5-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanyl-1,2,4-triazol-3-yl]-2-oxidanyl-ethyl]-3-methoxy-benzamide

Systemtic Name: N-[1-[4-ethyl-5-(3-oxidanylidene-3-phenylazanyl-propyl)sulfanyl-1,2,4-triazol-3-yl]-2-oxidanyl-ethyl]-3-methoxy-benzamide Openeye Name: N-[1-[5-(3-anilino-3-oxo-propyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-3-methoxy-benzamide CAS Name: N-[1-[5-[(3-anilino-3-oxopropyl)thio]-4-ethyl-1,2,4-triazol-3-yl]-2-hydroxyethyl]-3-methoxybenzamide IUPAC Name: N-[1-[5-(3-anilino-3-oxopropyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-hydroxyethyl]-3-methoxybenzamide Traditional Name: N-[1-[5-[(3-anilino-3-keto-propyl)thio]-4-ethyl-1,2,4-triazol-3-yl]-2-hydroxy-ethyl]-3-methoxy-benzamide Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2)C(CO)NC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCN1C(=NN=C1SCCC(=O)NC2=CC=CC=C2)C(CO)NC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C23H27N5O4S/c1-3-28-21(19(15-29)25-22(31)16-8-7-11-18(14-16)32-2)26-27-23(28)33-13-12-20(30)24-17-9-5-4-6-10-17/h4-11,14,19,29H,3,12-13,15H2,1-2H3,(H,24,30)(H,25,31)