ethyl 2-[2-[3-(dimethylamino)propylamino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(dimethylamino)propylamino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[3-(dimethylamino)propylamino]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[3-(dimethylamino)propylamino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(dimethylamino)propylamino]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[3-(dimethylamino)propylamino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CNCCCN(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CNCCCN(C)C

InChI

InChI=1S/C20H27N3O3S/c1-4-26-20(25)18-16(15-9-6-5-7-10-15)14-27-19(18)22-17(24)13-21-11-8-12-23(2)3/h5-7,9-10,14,21H,4,8,11-13H2,1-3H3,(H,22,24)