[3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone Openeye Name: [3,5-bis(2-thienylmethylamino)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone CAS Name: [3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone IUPAC Name: [3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone Traditional Name: [3,5-bis(2-thenylamino)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone Formula: C19H16N6O3S2 MolecularWeight: 440.49874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2C(=NC(=N2)NCC3=CC=CS3)NCC4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2C(=NC(=N2)NCC3=CC=CS3)NCC4=CC=CS4

InChI

InChI=1S/C19H16N6O3S2/c26-17(13-4-1-5-14(10-13)25(27)28)24-19(21-12-16-7-3-9-30-16)22-18(23-24)20-11-15-6-2-8-29-15/h1-10H,11-12H2,(H2,20,21,22,23)