(2R)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-2-nitro-phenyl)propanamide

Systemtic Name: (2R)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-2-nitro-phenyl)propanamide Openeye Name: (2R)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-2-nitro-phenyl)propanamide CAS Name: (2R)-2-[(4-ethyl-1,2,4-triazol-3-yl)thio]-N-(4-methoxy-2-nitrophenyl)propanamide IUPAC Name: (2R)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxy-2-nitrophenyl)propanamide Traditional Name: (2R)-2-[(4-ethyl-1,2,4-triazol-3-yl)thio]-N-(4-methoxy-2-nitro-phenyl)propionamide Formula: C14H17N5O4S MolecularWeight: 351.38088

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SC(C)C(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCN1C=NN=C1S[C@H](C)C(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O4S/c1-4-18-8-15-17-14(18)24-9(2)13(20)16-11-6-5-10(23-3)7-12(11)19(21)22/h5-9H,4H2,1-3H3,(H,16,20)/t9-/m1/s1