[3-azanyl-5-[(2,5-dimethylphenyl)amino]-4-ethylsulfonyl-thiophen-2-yl]-phenyl-methanone

Systemtic Name: [3-azanyl-5-[(2,5-dimethylphenyl)amino]-4-ethylsulfonyl-thiophen-2-yl]-phenyl-methanone Openeye Name: [3-amino-5-(2,5-dimethylanilino)-4-ethylsulfonyl-2-thienyl]-phenyl-methanone CAS Name: [3-amino-5-(2,5-dimethylanilino)-4-ethylsulfonyl-2-thiophenyl]-phenylmethanone IUPAC Name: [3-amino-5-(2,5-dimethylanilino)-4-ethylsulfonylthiophen-2-yl]-phenylmethanone Traditional Name: [3-amino-5-(2,5-dimethylanilino)-4-esyl-2-thienyl]-phenyl-methanone Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(SC(=C1N)C(=O)C2=CC=CC=C2)NC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCS(=O)(=O)C1=C(SC(=C1N)C(=O)C2=CC=CC=C2)NC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H22N2O3S2/c1-4-28(25,26)20-17(22)19(18(24)15-8-6-5-7-9-15)27-21(20)23-16-12-13(2)10-11-14(16)3/h5-12,23H,4,22H2,1-3H3