[4-[[2-(dimethylamino)-2-thiophen-2-yl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[2-(dimethylamino)-2-thiophen-2-yl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[[2-(dimethylamino)-2-(2-thienyl)ethyl]amino]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[2-(dimethylamino)-2-(2-thienyl)ethyl]amino]-3-nitro-phenyl]-phenyl-methanone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C21H21N3O3S/c1-23(2)19(20-9-6-12-28-20)14-22-17-11-10-16(13-18(17)24(26)27)21(25)15-7-4-3-5-8-15/h3-13,19,22H,14H2,1-2H3