ethyl 4-cyclopropyl-2-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-cyclopropyl-2-[2-[(4-dimethylaminophenyl)methyl-methyl-amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-cyclopropyl-2-[[2-[(4-dimethylaminophenyl)methyl-methyl-amino]acetyl]amino]thiophene-3-carboxylate CAS Name: 4-cyclopropyl-2-[[2-[(4-dimethylaminophenyl)methyl-methylamino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyclopropyl-2-[[2-[(4-dimethylaminophenyl)methyl-methylamino]acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-cyclopropyl-2-[[2-[[4-(dimethylamino)benzyl]-methyl-amino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CN(C)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CN(C)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H29N3O3S/c1-5-28-22(27)20-18(16-8-9-16)14-29-21(20)23-19(26)13-25(4)12-15-6-10-17(11-7-15)24(2)3/h6-7,10-11,14,16H,5,8-9,12-13H2,1-4H3,(H,23,26)