[3-azanyl-5-[(2,6-diethylphenyl)amino]-4-(phenylsulfonyl)thiophen-2-yl]-phenyl-methanone

Systemtic Name: [3-azanyl-5-[(2,6-diethylphenyl)amino]-4-(phenylsulfonyl)thiophen-2-yl]-phenyl-methanone Openeye Name: [3-amino-4-(benzenesulfonyl)-5-(2,6-diethylanilino)-2-thienyl]-phenyl-methanone CAS Name: [3-amino-4-(benzenesulfonyl)-5-(2,6-diethylanilino)-2-thiophenyl]-phenylmethanone IUPAC Name: [3-amino-4-(benzenesulfonyl)-5-(2,6-diethylanilino)thiophen-2-yl]-phenylmethanone Traditional Name: [3-amino-4-besyl-5-(2,6-diethylanilino)-2-thienyl]-phenyl-methanone Formula: C27H26N2O3S2 MolecularWeight: 490.63694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC2=C(C(=C(S2)C(=O)C3=CC=CC=C3)N)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC2=C(C(=C(S2)C(=O)C3=CC=CC=C3)N)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O3S2/c1-3-18-14-11-15-19(4-2)23(18)29-27-26(34(31,32)21-16-9-6-10-17-21)22(28)25(33-27)24(30)20-12-7-5-8-13-20/h5-17,29H,3-4,28H2,1-2H3