N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-4-piperidinosulfonyl-benzamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H24ClN3O4S/c1-15-18(22)6-5-7-19(15)24-20(26)14-23-21(27)16-8-10-17(11-9-16)30(28,29)25-12-3-2-4-13-25/h5-11H,2-4,12-14H2,1H3,(H,23,27)(H,24,26)