2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(3-methyl-1-benzothiophen-2-yl)ethanone

Systemtic Name: 2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(3-methyl-1-benzothiophen-2-yl)ethanone Openeye Name: 2-[[5-(2-furylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(3-methylbenzothiophen-2-yl)ethanone CAS Name: 2-[[5-(2-furanylmethylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(3-methyl-1-benzothiophen-2-yl)ethanone IUPAC Name: 2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-1-(3-methyl-1-benzothiophen-2-yl)ethanone Traditional Name: 2-[[5-(2-furfurylamino)-1,3,4-thiadiazol-2-yl]thio]-1-(3-methylbenzothiophen-2-yl)ethanone Formula: C18H15N3O2S3 MolecularWeight: 401.5256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)CSC3=NN=C(S3)NCC4=CC=CO4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)CSC3=NN=C(S3)NCC4=CC=CO4

InChI

InChI=1S/C18H15N3O2S3/c1-11-13-6-2-3-7-15(13)25-16(11)14(22)10-24-18-21-20-17(26-18)19-9-12-5-4-8-23-12/h2-8H,9-10H2,1H3,(H,19,20)