N-(4-butoxyphenyl)-2-[4-[2-(4-chlorophenyl)ethanoylamino]phenyl]sulfanyl-propanamide

Systemtic Name: N-(4-butoxyphenyl)-2-[4-[2-(4-chlorophenyl)ethanoylamino]phenyl]sulfanyl-propanamide Openeye Name: N-(4-butoxyphenyl)-2-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]sulfanyl-propanamide CAS Name: N-(4-butoxyphenyl)-2-[[4-[[2-(4-chlorophenyl)-1-oxoethyl]amino]phenyl]thio]propanamide IUPAC Name: N-(4-butoxyphenyl)-2-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]sulfanylpropanamide Traditional Name: N-(4-butoxyphenyl)-2-[[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]thio]propionamide Formula: C27H29ClN2O3S MolecularWeight: 497.04876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C27H29ClN2O3S/c1-3-4-17-33-24-13-9-23(10-14-24)30-27(32)19(2)34-25-15-11-22(12-16-25)29-26(31)18-20-5-7-21(28)8-6-20/h5-16,19H,3-4,17-18H2,1-2H3,(H,29,31)(H,30,32)