1-ethyl-3-[4-[4-[(2-oxidanylidene-4-sulfanyl-pyrrolidin-1-yl)methyl]phenoxy]phenyl]urea

Systemtic Name: 1-ethyl-3-[4-[4-[(2-oxidanylidene-4-sulfanyl-pyrrolidin-1-yl)methyl]phenoxy]phenyl]urea Openeye Name: 1-ethyl-3-[4-[4-[(2-oxo-4-sulfanyl-pyrrolidin-1-yl)methyl]phenoxy]phenyl]urea CAS Name: 1-ethyl-3-[4-[4-[(4-mercapto-2-oxo-1-pyrrolidinyl)methyl]phenoxy]phenyl]urea IUPAC Name: 1-ethyl-3-[4-[4-[(2-oxo-4-sulfanylpyrrolidin-1-yl)methyl]phenoxy]phenyl]urea Traditional Name: 1-ethyl-3-[4-[4-[(2-keto-4-mercapto-pyrrolidino)methyl]phenoxy]phenyl]urea Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC=C(C=C1)OC2=CC=C(C=C2)CN3CC(CC3=O)S

Isomeric SMILES

CCNC(=O)NC1=CC=C(C=C1)OC2=CC=C(C=C2)CN3CC(CC3=O)S

InChI

InChI=1S/C20H23N3O3S/c1-2-21-20(25)22-15-5-9-17(10-6-15)26-16-7-3-14(4-8-16)12-23-13-18(27)11-19(23)24/h3-10,18,27H,2,11-13H2,1H3,(H2,21,22,25)