4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(3-phenylpropyl)butanamide

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(3-phenylpropyl)butanamide Openeye Name: 4-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-(3-phenylpropyl)butanamide CAS Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-(3-phenylpropyl)butanamide IUPAC Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-(3-phenylpropyl)butanamide Traditional Name: 4-(5-chloro-N-mesyl-2-methyl-anilino)-N-(3-phenylpropyl)butyramide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NCCCC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O3S/c1-17-12-13-19(22)16-20(17)24(28(2,26)27)15-7-11-21(25)23-14-6-10-18-8-4-3-5-9-18/h3-5,8-9,12-13,16H,6-7,10-11,14-15H2,1-2H3,(H,23,25)