3-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]ethanoylamino]-N-cyclopropyl-benzamide

Systemtic Name: 3-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]ethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 3-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]acetyl]amino]-N-cyclopropyl-benzamide CAS Name: 3-[[2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]acetyl]amino]-N-cyclopropylbenzamide Traditional Name: 3-[[2-[4-[(5-chloro-2-thienyl)methyl]piperazino]acetyl]amino]-N-cyclopropyl-benzamide Formula: C21H25ClN4O2S MolecularWeight: 432.9668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN3CCN(CC3)CC4=CC=C(S4)Cl

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN3CCN(CC3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C21H25ClN4O2S/c22-19-7-6-18(29-19)13-25-8-10-26(11-9-25)14-20(27)23-17-3-1-2-15(12-17)21(28)24-16-4-5-16/h1-3,6-7,12,16H,4-5,8-11,13-14H2,(H,23,27)(H,24,28)