2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-butoxy-2-oxidanyl-1-(3-propylphenyl)ethanone

Systemtic Name: 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-butoxy-2-oxidanyl-1-(3-propylphenyl)ethanone Openeye Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-2-butoxy-2-hydroxy-1-(3-propylphenyl)ethanone CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-2-butoxy-2-hydroxy-1-(3-propylphenyl)ethanone IUPAC Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-2-butoxy-2-hydroxy-1-(3-propylphenyl)ethanone Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-2-butoxy-2-hydroxy-1-(3-propylphenyl)ethanone Formula: C17H23N3O3S2 MolecularWeight: 381.51282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C(=O)C1=CC(=CC=C1)CCC)(O)SC2=NN=C(S2)N

Isomeric SMILES

CCCCOC(C(=O)C1=CC(=CC=C1)CCC)(O)SC2=NN=C(S2)N

InChI

InChI=1S/C17H23N3O3S2/c1-3-5-10-23-17(22,25-16-20-19-15(18)24-16)14(21)13-9-6-8-12(11-13)7-4-2/h6,8-9,11,22H,3-5,7,10H2,1-2H3,(H2,18,19)