N-(4-acetamidophenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide Openeye Name: N-(4-acetamidophenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanyl-propanamide CAS Name: N-(4-acetamidophenyl)-2-[[3-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]phenyl]thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanylpropanamide Traditional Name: N-(4-acetamidophenyl)-2-[[3-[(2-methoxyphenyl)thiocarbamoylamino]phenyl]thio]propionamide Formula: C25H26N4O3S2 MolecularWeight: 494.62894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3OC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C25H26N4O3S2/c1-16(24(31)27-19-13-11-18(12-14-19)26-17(2)30)34-21-8-6-7-20(15-21)28-25(33)29-22-9-4-5-10-23(22)32-3/h4-16H,1-3H3,(H,26,30)(H,27,31)(H2,28,29,33)