2-[2-[(4-dimethylaminophenyl)methyl-ethyl-amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[(4-dimethylaminophenyl)methyl-ethyl-amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-[(4-dimethylaminophenyl)methyl-ethyl-amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[(4-dimethylaminophenyl)methyl-ethylamino]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-[(4-dimethylaminophenyl)methyl-ethylamino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-[[4-(dimethylamino)benzyl]-ethyl-amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)N(C)C)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

Isomeric SMILES

CCN(CC1=CC=C(C=C1)N(C)C)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

InChI

InChI=1S/C22H30N4O2S/c1-4-26(13-15-9-11-16(12-10-15)25(2)3)14-19(27)24-22-20(21(23)28)17-7-5-6-8-18(17)29-22/h9-12H,4-8,13-14H2,1-3H3,(H2,23,28)(H,24,27)