4,6-dimethyl-3-[(4-methylphenyl)carbonylamino]-N-prop-2-enyl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 4,6-dimethyl-3-[(4-methylphenyl)carbonylamino]-N-prop-2-enyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-allyl-4,6-dimethyl-3-[(4-methylbenzoyl)amino]thieno[2,3-b]pyridine-2-carboxamide CAS Name: 4,6-dimethyl-3-[[(4-methylphenyl)-oxomethyl]amino]-N-prop-2-enyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 4,6-dimethyl-3-[(4-methylbenzoyl)amino]-N-prop-2-enylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-allyl-4,6-dimethyl-3-(p-toluoylamino)thieno[2,3-b]pyridine-2-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(SC3=C2C(=CC(=N3)C)C)C(=O)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(SC3=C2C(=CC(=N3)C)C)C(=O)NCC=C

InChI

InChI=1S/C21H21N3O2S/c1-5-10-22-20(26)18-17(16-13(3)11-14(4)23-21(16)27-18)24-19(25)15-8-6-12(2)7-9-15/h5-9,11H,1,10H2,2-4H3,(H,22,26)(H,24,25)