4-azanyl-5-chloranyl-2-methoxy-N-[1-[[1-[(E)-3-thiophen-3-ylprop-2-enoyl]piperidin-4-yl]methyl]piperidin-4-yl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[1-[[1-[(E)-3-thiophen-3-ylprop-2-enoyl]piperidin-4-yl]methyl]piperidin-4-yl]benzamide Openeye Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-3-(3-thienyl)prop-2-enoyl]-4-piperidyl]methyl]-4-piperidyl]benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-1-oxo-3-(3-thiophenyl)prop-2-enyl]-4-piperidinyl]methyl]-4-piperidinyl]benzamide IUPAC Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-3-thiophen-3-ylprop-2-enoyl]piperidin-4-yl]methyl]piperidin-4-yl]benzamide Traditional Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-3-(3-thienyl)acryloyl]-4-piperidyl]methyl]-4-piperidyl]benzamide Formula: C26H33ClN4O3S MolecularWeight: 517.08322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)C=CC4=CSC=C4)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)/C=C/C4=CSC=C4)Cl)N

InChI

InChI=1S/C26H33ClN4O3S/c1-34-24-15-23(28)22(27)14-21(24)26(33)29-20-6-9-30(10-7-20)16-18-4-11-31(12-5-18)25(32)3-2-19-8-13-35-17-19/h2-3,8,13-15,17-18,20H,4-7,9-12,16,28H2,1H3,(H,29,33)/b3-2+