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

Systemtic Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxo-butanamide CAS Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-[4-(4-nitrophenyl)-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-4-oxobutanamide Traditional Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4-keto-4-[4-(4-nitrophenyl)piperazino]butyramide Formula: C22H28N6O4S MolecularWeight: 472.56052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(S2)NC(=O)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=NN=C(S2)NC(=O)CCC(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H28N6O4S/c29-19(23-22-25-24-21(33-22)16-4-2-1-3-5-16)10-11-20(30)27-14-12-26(13-15-27)17-6-8-18(9-7-17)28(31)32/h6-9,16H,1-5,10-15H2,(H,23,25,29)