2-[4-(3-chloranyl-4-methoxy-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-cyclopentyl-ethanamide

Systemtic Name: 2-[4-(3-chloranyl-4-methoxy-phenyl)-3-oxidanylidene-pyrazin-2-yl]sulfanyl-N-cyclopentyl-ethanamide Openeye Name: 2-[4-(3-chloro-4-methoxy-phenyl)-3-oxo-pyrazin-2-yl]sulfanyl-N-cyclopentyl-acetamide CAS Name: 2-[[4-(3-chloro-4-methoxyphenyl)-3-oxo-2-pyrazinyl]thio]-N-cyclopentylacetamide IUPAC Name: 2-[4-(3-chloro-4-methoxyphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-cyclopentylacetamide Traditional Name: 2-[[4-(3-chloro-4-methoxy-phenyl)-3-keto-pyrazin-2-yl]thio]-N-cyclopentyl-acetamide Formula: C18H20ClN3O3S MolecularWeight: 393.8877

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NC3CCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NC3CCCC3)Cl

InChI

InChI=1S/C18H20ClN3O3S/c1-25-15-7-6-13(10-14(15)19)22-9-8-20-17(18(22)24)26-11-16(23)21-12-4-2-3-5-12/h6-10,12H,2-5,11H2,1H3,(H,21,23)