N-[2-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-cyano-N-methyl-benzamide

Systemtic Name: N-[2-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-cyano-N-methyl-benzamide Openeye Name: N-[2-(4-chloro-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]-4-cyano-N-methyl-benzamide CAS Name: N-[2-[4-chloro-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-4-cyano-N-methylbenzamide IUPAC Name: N-[2-(4-chloro-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]-4-cyano-N-methylbenzamide Traditional Name: N-[2-(4-chloro-3-morpholinosulfonyl-anilino)-2-keto-ethyl]-4-cyano-N-methyl-benzamide Formula: C21H21ClN4O5S MolecularWeight: 476.93324

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCOCC2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN(CC(=O)NC1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCOCC2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21ClN4O5S/c1-25(21(28)16-4-2-15(13-23)3-5-16)14-20(27)24-17-6-7-18(22)19(12-17)32(29,30)26-8-10-31-11-9-26/h2-7,12H,8-11,14H2,1H3,(H,24,27)