N-[1-[4-chloranyl-3-(phenylmethyl)-2-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide

Systemtic Name: N-[1-[4-chloranyl-3-(phenylmethyl)-2-propan-2-ylsulfonyl-phenyl]-3-oxidanylidene-propyl]methanamide Openeye Name: N-[1-(3-benzyl-4-chloro-2-isopropylsulfonyl-phenyl)-3-oxo-propyl]formamide CAS Name: N-[1-[4-chloro-3-(phenylmethyl)-2-propan-2-ylsulfonylphenyl]-3-oxopropyl]formamide IUPAC Name: N-[1-(3-benzyl-4-chloro-2-propan-2-ylsulfonylphenyl)-3-oxopropyl]formamide Traditional Name: N-[1-(3-benzyl-4-chloro-2-isopropylsulfonyl-phenyl)-3-keto-propyl]formamide Formula: C20H22ClNO4S MolecularWeight: 407.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=CC(=C1CC2=CC=CC=C2)Cl)C(CC=O)NC=O

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=CC(=C1CC2=CC=CC=C2)Cl)C(CC=O)NC=O

InChI

InChI=1S/C20H22ClNO4S/c1-14(2)27(25,26)20-16(19(10-11-23)22-13-24)8-9-18(21)17(20)12-15-6-4-3-5-7-15/h3-9,11,13-14,19H,10,12H2,1-2H3,(H,22,24)