2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-methoxyphenyl)propan-1-one

Systemtic Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-methoxyphenyl)propan-1-one Openeye Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-methoxyphenyl)propan-1-one CAS Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(4-methoxyphenyl)-1-propanone IUPAC Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(4-methoxyphenyl)propan-1-one Traditional Name: 2-[[5-(butylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(4-methoxyphenyl)propan-1-one Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SC(C)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCNC1=NN=C(S1)SC(C)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H21N3O2S2/c1-4-5-10-17-15-18-19-16(23-15)22-11(2)14(20)12-6-8-13(21-3)9-7-12/h6-9,11H,4-5,10H2,1-3H3,(H,17,18)