2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(3-nitrophenyl)thiazol-2-yl]propanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-[4-(3-nitrophenyl)-2-thiazolyl]propanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]propanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-[4-(3-nitrophenyl)thiazol-2-yl]propionamide Formula: C16H17N7O3S2 MolecularWeight: 419.48128

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C(C)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

CCSC1=NN=C(N1C(C)C(=O)NC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])N

InChI

InChI=1S/C16H17N7O3S2/c1-3-27-16-21-20-14(17)22(16)9(2)13(24)19-15-18-12(8-28-15)10-5-4-6-11(7-10)23(25)26/h4-9H,3H2,1-2H3,(H2,17,20)(H,18,19,24)