1-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]urea

Systemtic Name: 1-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]urea Openeye Name: 1-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]urea CAS Name: 1-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]urea IUPAC Name: 1-[2-(diethylamino)-2-thiophen-3-ylethyl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]urea Traditional Name: 1-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-[4-(2-ketopyrrolidino)phenyl]urea Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)NC1=CC=C(C=C1)N2CCCC2=O)C3=CSC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)NC1=CC=C(C=C1)N2CCCC2=O)C3=CSC=C3

InChI

InChI=1S/C21H28N4O2S/c1-3-24(4-2)19(16-11-13-28-15-16)14-22-21(27)23-17-7-9-18(10-8-17)25-12-5-6-20(25)26/h7-11,13,15,19H,3-6,12,14H2,1-2H3,(H2,22,23,27)