4-cyano-5-[2-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-3-methyl-thiophene-2-carboxamide

Systemtic Name: 4-cyano-5-[2-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]ethanoylamino]-3-methyl-thiophene-2-carboxamide Openeye Name: 4-cyano-5-[[2-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-3-methyl-thiophene-2-carboxamide CAS Name: 4-cyano-5-[[2-[4-[(2-methoxyphenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxamide IUPAC Name: 4-cyano-5-[[2-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]acetyl]amino]-3-methylthiophene-2-carboxamide Traditional Name: 4-cyano-3-methyl-5-[[2-(4-o-anisylpiperazino)acetyl]amino]thiophene-2-carboxamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3OC)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3OC)C(=O)N

InChI

InChI=1S/C21H25N5O3S/c1-14-16(11-22)21(30-19(14)20(23)28)24-18(27)13-26-9-7-25(8-10-26)12-15-5-3-4-6-17(15)29-2/h3-6H,7-10,12-13H2,1-2H3,(H2,23,28)(H,24,27)