2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]thio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C17H23N5O3S3 MolecularWeight: 441.59122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN=C(S1)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)NC1=NN=C(S1)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C17H23N5O3S3/c1-12(2)18-16-20-21-17(27-16)26-11-15(23)19-13-6-5-7-14(10-13)28(24,25)22-8-3-4-9-22/h5-7,10,12H,3-4,8-9,11H2,1-2H3,(H,18,20)(H,19,23)