5-[2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]ethanoylamino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide

Systemtic Name: 5-[2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]ethanoylamino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide Openeye Name: 5-[[2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]acetyl]amino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide CAS Name: 5-[[2-[4-[(3-bromophenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-4-cyano-N,N-diethyl-3-methyl-2-thiophenecarboxamide IUPAC Name: 5-[[2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]acetyl]amino]-4-cyano-N,N-diethyl-3-methylthiophene-2-carboxamide Traditional Name: 5-[[2-[4-(3-bromobenzyl)piperazino]acetyl]amino]-4-cyano-N,N-diethyl-3-methyl-thiophene-2-carboxamide Formula: C24H30BrN5O2S MolecularWeight: 532.4963

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br)C#N)C

InChI

InChI=1S/C24H30BrN5O2S/c1-4-30(5-2)24(32)22-17(3)20(14-26)23(33-22)27-21(31)16-29-11-9-28(10-12-29)15-18-7-6-8-19(25)13-18/h6-8,13H,4-5,9-12,15-16H2,1-3H3,(H,27,31)