3-tert-butyl-4-[(Z)-[5-(3-nitrophenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-tert-butyl-4-[(Z)-[5-(3-nitrophenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-tert-butyl-4-[(Z)-[5-(3-nitrophenyl)-2-furyl]methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-tert-butyl-4-[(Z)-[5-(3-nitrophenyl)-2-furanyl]methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-tert-butyl-4-[(Z)-[5-(3-nitrophenyl)furan-2-yl]methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-tert-butyl-4-[(Z)-[5-(3-nitrophenyl)-2-furyl]methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NNC(=S)N1N=CC2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NNC(=S)N1/N=C\C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3S/c1-17(2,3)15-19-20-16(26)21(15)18-10-13-7-8-14(25-13)11-5-4-6-12(9-11)22(23)24/h4-10H,1-3H3,(H,20,26)/b18-10-