5-[4-[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[4-(5-chloro-2-thienyl)-4-oxo-butanoyl]piperazin-1-yl]-2-cyclopropyl-oxazole-4-carbonitrile CAS Name: 5-[4-[4-(5-chloro-2-thiophenyl)-1,4-dioxobutyl]-1-piperazinyl]-2-cyclopropyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-[4-(5-chlorothiophen-2-yl)-4-oxobutanoyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-[4-(5-chloro-2-thienyl)-4-keto-butanoyl]piperazino]-2-cyclopropyl-oxazole-4-carbonitrile Formula: C19H19ClN4O3S MolecularWeight: 418.89716

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)CCC(=O)C4=CC=C(S4)Cl)C#N

Isomeric SMILES

C1CC1C2=NC(=C(O2)N3CCN(CC3)C(=O)CCC(=O)C4=CC=C(S4)Cl)C#N

InChI

InChI=1S/C19H19ClN4O3S/c20-16-5-4-15(28-16)14(25)3-6-17(26)23-7-9-24(10-8-23)19-13(11-21)22-18(27-19)12-1-2-12/h4-5,12H,1-3,6-10H2