N-(4-butoxyphenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-ethanamide

Systemtic Name: N-(4-butoxyphenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-ethanamide Openeye Name: N-(4-butoxyphenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-acetamide CAS Name: N-(4-butoxyphenyl)-2-[[3-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]phenyl]thio]acetamide IUPAC Name: N-(4-butoxyphenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanylacetamide Traditional Name: N-(4-butoxyphenyl)-2-[[3-[(2-methoxyphenyl)thiocarbamoylamino]phenyl]thio]acetamide Formula: C26H29N3O3S2 MolecularWeight: 495.65676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C26H29N3O3S2/c1-3-4-16-32-21-14-12-19(13-15-21)27-25(30)18-34-22-9-7-8-20(17-22)28-26(33)29-23-10-5-6-11-24(23)31-2/h5-15,17H,3-4,16,18H2,1-2H3,(H,27,30)(H2,28,29,33)