3-(furan-2-ylmethylamino)-N-(4-methylphenyl)-1,1-bis(oxidanylidene)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-(furan-2-ylmethylamino)-N-(4-methylphenyl)-1,1-bis(oxidanylidene)-1-benzothiophene-2-carboxamide Openeye Name: 3-(2-furylmethylamino)-1,1-dioxo-N-(p-tolyl)benzothiophene-2-carboxamide CAS Name: 3-(2-furanylmethylamino)-N-(4-methylphenyl)-1,1-dioxo-1-benzothiophene-2-carboxamide IUPAC Name: 3-(furan-2-ylmethylamino)-N-(4-methylphenyl)-1,1-dioxo-1-benzothiophene-2-carboxamide Traditional Name: 3-(2-furfurylamino)-1,1-diketo-N-(p-tolyl)benzothiophene-2-carboxamide Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2(=O)=O)NCC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2(=O)=O)NCC4=CC=CO4

InChI

InChI=1S/C21H18N2O4S/c1-14-8-10-15(11-9-14)23-21(24)20-19(22-13-16-5-4-12-27-16)17-6-2-3-7-18(17)28(20,25)26/h2-12,22H,13H2,1H3,(H,23,24)