3-(3,4-dimethylphenyl)-4-(thiophen-2-ylmethylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3,4-dimethylphenyl)-4-(thiophen-2-ylmethylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(3,4-dimethylphenyl)-4-(2-thienylmethylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(3,4-dimethylphenyl)-4-(thiophen-2-ylmethylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3,4-dimethylphenyl)-4-(thiophen-2-ylmethylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(3,4-dimethylphenyl)-4-(2-thenylamino)cyclobut-3-ene-1,2-quinone Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C(=O)C2=O)NCC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C(=O)C2=O)NCC3=CC=CS3)C

InChI

InChI=1S/C17H15NO2S/c1-10-5-6-12(8-11(10)2)14-15(17(20)16(14)19)18-9-13-4-3-7-21-13/h3-8,18H,9H2,1-2H3