4-nitro-N-(thiophen-2-ylmethyl)aniline; 1H-1,2,4-triazole

Systemtic Name: 4-nitro-N-(thiophen-2-ylmethyl)aniline; 1H-1,2,4-triazole Openeye Name: 4-nitro-N-(2-thienylmethyl)aniline; 1H-1,2,4-triazole CAS Name: 4-nitro-N-(thiophen-2-ylmethyl)aniline; 1H-1,2,4-triazole IUPAC Name: 4-nitro-N-(thiophen-2-ylmethyl)aniline; 1H-1,2,4-triazole Traditional Name: (4-nitrophenyl)-(2-thenyl)amine; 1H-1,2,4-triazole Formula: C13H13N5O2S MolecularWeight: 303.33962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC2=CC=C(C=C2)[N+](=O)[O-].C1=NC=NN1

Isomeric SMILES

C1=CSC(=C1)CNC2=CC=C(C=C2)[N+](=O)[O-].C1=NC=NN1

InChI

InChI=1S/C11H10N2O2S.C2H3N3/c14-13(15)10-5-3-9(4-6-10)12-8-11-2-1-7-16-11;1-3-2-5-4-1/h1-7,12H,8H2;1-2H,(H,3,4,5)