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

Systemtic Name: 1-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-3-(4-methyl-3-nitro-phenyl)urea Openeye Name: 1-[2-(dimethylamino)-2-(3-thienyl)ethyl]-3-(4-methyl-3-nitro-phenyl)urea CAS Name: 1-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-3-(4-methyl-3-nitrophenyl)urea IUPAC Name: 1-[2-(dimethylamino)-2-thiophen-3-ylethyl]-3-(4-methyl-3-nitrophenyl)urea Traditional Name: 1-[2-(dimethylamino)-2-(3-thienyl)ethyl]-3-(4-methyl-3-nitro-phenyl)urea Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCC(C2=CSC=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCC(C2=CSC=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O3S/c1-11-4-5-13(8-14(11)20(22)23)18-16(21)17-9-15(19(2)3)12-6-7-24-10-12/h4-8,10,15H,9H2,1-3H3,(H2,17,18,21)