4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-butanamide Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxo-butanamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-4-oxobutanamide IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-4-keto-butyramide Formula: C18H22ClN5O2S2 MolecularWeight: 439.98258

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H22ClN5O2S2/c1-2-27-18-22-21-17(28-18)20-15(25)6-7-16(26)24-10-8-23(9-11-24)14-5-3-4-13(19)12-14/h3-5,12H,2,6-11H2,1H3,(H,20,21,25)