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

Systemtic Name: N-(4-butoxyphenyl)-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(4-butoxyphenyl)-2-[4-(phenylcarbamoylamino)phenyl]sulfanyl-propanamide CAS Name: 2-[[4-[[anilino(oxo)methyl]amino]phenyl]thio]-N-(4-butoxyphenyl)propanamide IUPAC Name: N-(4-butoxyphenyl)-2-[4-(phenylcarbamoylamino)phenyl]sulfanylpropanamide Traditional Name: N-(4-butoxyphenyl)-2-[[4-(phenylcarbamoylamino)phenyl]thio]propionamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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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)NC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C26H29N3O3S/c1-3-4-18-32-23-14-10-21(11-15-23)27-25(30)19(2)33-24-16-12-22(13-17-24)29-26(31)28-20-8-6-5-7-9-20/h5-17,19H,3-4,18H2,1-2H3,(H,27,30)(H2,28,29,31)