N-[(3,4-dimethoxyphenyl)methyl]-5-methyl-2-[(2-nitrophenyl)carbonylamino]thiophene-3-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-5-methyl-2-[(2-nitrophenyl)carbonylamino]thiophene-3-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-5-methyl-2-[(2-nitrobenzoyl)amino]thiophene-3-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-5-methyl-2-[[(2-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-5-methyl-2-[(2-nitrobenzoyl)amino]thiophene-3-carboxamide Traditional Name: 5-methyl-2-[(2-nitrobenzoyl)amino]-N-veratryl-thiophene-3-carboxamide Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H21N3O6S/c1-13-10-16(20(26)23-12-14-8-9-18(30-2)19(11-14)31-3)22(32-13)24-21(27)15-6-4-5-7-17(15)25(28)29/h4-11H,12H2,1-3H3,(H,23,26)(H,24,27)