1-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-3-(4-methoxy-2-nitro-phenyl)urea

Systemtic Name: 1-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-3-(4-methoxy-2-nitro-phenyl)urea Openeye Name: 1-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-(4-methoxy-2-nitro-phenyl)urea CAS Name: 1-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-(4-methoxy-2-nitrophenyl)urea IUPAC Name: 1-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-(4-methoxy-2-nitrophenyl)urea Traditional Name: 1-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-(4-methoxy-2-nitro-phenyl)urea Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])C2=CC=CS2

Isomeric SMILES

CN(C)C(CNC(=O)NC1=C(C=C(C=C1)OC)[N+](=O)[O-])C2=CC=CS2

InChI

InChI=1S/C16H20N4O4S/c1-19(2)14(15-5-4-8-25-15)10-17-16(21)18-12-7-6-11(24-3)9-13(12)20(22)23/h4-9,14H,10H2,1-3H3,(H2,17,18,21)