N-(2-aminocarbonyl-4-chloranyl-6-methoxy-phenyl)-3-chloranyl-4-[(2-pyrimidin-2-ylpiperazin-1-yl)methyl]thiophene-2-carboxamide

Systemtic Name: N-(2-aminocarbonyl-4-chloranyl-6-methoxy-phenyl)-3-chloranyl-4-[(2-pyrimidin-2-ylpiperazin-1-yl)methyl]thiophene-2-carboxamide Openeye Name: N-(2-carbamoyl-4-chloro-6-methoxy-phenyl)-3-chloro-4-[(2-pyrimidin-2-ylpiperazin-1-yl)methyl]thiophene-2-carboxamide CAS Name: N-(2-carbamoyl-4-chloro-6-methoxyphenyl)-3-chloro-4-[[2-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-(2-carbamoyl-4-chloro-6-methoxyphenyl)-3-chloro-4-[(2-pyrimidin-2-ylpiperazin-1-yl)methyl]thiophene-2-carboxamide Traditional Name: N-(2-carbamoyl-4-chloro-6-methoxy-phenyl)-3-chloro-4-[[2-(2-pyrimidyl)piperazino]methyl]thiophene-2-carboxamide Formula: C22H22Cl2N6O3S MolecularWeight: 521.41948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Cl)C(=O)N)NC(=O)C2=C(C(=CS2)CN3CCNCC3C4=NC=CC=N4)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)Cl)C(=O)N)NC(=O)C2=C(C(=CS2)CN3CCNCC3C4=NC=CC=N4)Cl

InChI

InChI=1S/C22H22Cl2N6O3S/c1-33-16-8-13(23)7-14(20(25)31)18(16)29-22(32)19-17(24)12(11-34-19)10-30-6-5-26-9-15(30)21-27-3-2-4-28-21/h2-4,7-8,11,15,26H,5-6,9-10H2,1H3,(H2,25,31)(H,29,32)