methyl 5-aminocarbonyl-4-methyl-2-[[5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[[5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[[5-[(4-methyl-2-nitro-phenoxy)methyl]furan-2-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[[5-[(4-methyl-2-nitrophenoxy)methyl]-2-furanyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[[5-[(4-methyl-2-nitrophenoxy)methyl]furan-2-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[5-[(4-methyl-2-nitro-phenoxy)methyl]-2-furoyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H19N3O8S MolecularWeight: 473.45586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=C(C(=C(S3)C(=O)N)C)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=C(C(=C(S3)C(=O)N)C)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O8S/c1-10-4-6-14(13(8-10)24(28)29)31-9-12-5-7-15(32-12)19(26)23-20-16(21(27)30-3)11(2)17(33-20)18(22)25/h4-8H,9H2,1-3H3,(H2,22,25)(H,23,26)