3-(butanoylamino)-4-(4-chlorophenyl)sulfanyl-N,N-diethyl-benzamide

Systemtic Name: 3-(butanoylamino)-4-(4-chlorophenyl)sulfanyl-N,N-diethyl-benzamide Openeye Name: 3-(butanoylamino)-4-(4-chlorophenyl)sulfanyl-N,N-diethyl-benzamide CAS Name: 4-[(4-chlorophenyl)thio]-N,N-diethyl-3-(1-oxobutylamino)benzamide IUPAC Name: 3-(butanoylamino)-4-(4-chlorophenyl)sulfanyl-N,N-diethylbenzamide Traditional Name: 3-butyramido-4-[(4-chlorophenyl)thio]-N,N-diethyl-benzamide Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=CC(=C1)C(=O)N(CC)CC)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCC(=O)NC1=C(C=CC(=C1)C(=O)N(CC)CC)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O2S/c1-4-7-20(25)23-18-14-15(21(26)24(5-2)6-3)8-13-19(18)27-17-11-9-16(22)10-12-17/h8-14H,4-7H2,1-3H3,(H,23,25)