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

Systemtic Name: N-(2-aminocarbonyl-4-chloranyl-6-methoxy-phenyl)-3-chloranyl-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thiophene-2-carboxamide Openeye Name: N-(2-carbamoyl-4-chloro-6-methoxy-phenyl)-3-chloro-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thiophene-2-carboxamide CAS Name: N-(2-carbamoyl-4-chloro-6-methoxyphenyl)-3-chloro-4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-(2-carbamoyl-4-chloro-6-methoxyphenyl)-3-chloro-4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thiophene-2-carboxamide Traditional Name: N-(2-carbamoyl-4-chloro-6-methoxy-phenyl)-3-chloro-4-[[4-(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)CN3CCN(CC3)C4=NC=CC=N4)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)Cl)C(=O)N)NC(=O)C2=C(C(=CS2)CN3CCN(CC3)C4=NC=CC=N4)Cl

InChI

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