1-[3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[3,5-bis(2-thienylmethylamino)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one CAS Name: 1-[3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[3,5-bis(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-3-methylbutan-1-one Traditional Name: 1-[3,5-bis(2-thenylamino)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Formula: C17H21N5OS2 MolecularWeight: 375.51154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(=NC(=N1)NCC2=CC=CS2)NCC3=CC=CS3

Isomeric SMILES

CC(C)CC(=O)N1C(=NC(=N1)NCC2=CC=CS2)NCC3=CC=CS3

InChI

InChI=1S/C17H21N5OS2/c1-12(2)9-15(23)22-17(19-11-14-6-4-8-25-14)20-16(21-22)18-10-13-5-3-7-24-13/h3-8,12H,9-11H2,1-2H3,(H2,18,19,20,21)