2-[[5-[cyclopropyl(propanoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-butanamide

Systemtic Name: 2-[[5-[cyclopropyl(propanoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-butanamide Openeye Name: 2-[[5-[cyclopropyl(propanoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-butanamide CAS Name: 2-[[5-[cyclopropyl(1-oxopropyl)amino]-1,3,4-thiadiazol-2-yl]thio]-N-phenylbutanamide IUPAC Name: 2-[[5-[cyclopropyl(propanoyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenylbutanamide Traditional Name: 2-[[5-[cyclopropyl(propionyl)amino]-1,3,4-thiadiazol-2-yl]thio]-N-phenyl-butyramide Formula: C18H22N4O2S2 MolecularWeight: 390.52288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)SC2=NN=C(S2)N(C3CC3)C(=O)CC

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)SC2=NN=C(S2)N(C3CC3)C(=O)CC

InChI

InChI=1S/C18H22N4O2S2/c1-3-14(16(24)19-12-8-6-5-7-9-12)25-18-21-20-17(26-18)22(13-10-11-13)15(23)4-2/h5-9,13-14H,3-4,10-11H2,1-2H3,(H,19,24)