(5-methyl-4-nitro-thiophen-2-yl)-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (5-methyl-4-nitro-thiophen-2-yl)-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: [4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-(5-methyl-4-nitro-2-thienyl)methanone CAS Name: (5-methyl-4-nitro-2-thiophenyl)-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (5-methyl-4-nitrothiophen-2-yl)-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: [4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-(5-methyl-4-nitro-2-thienyl)methanone Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC(=C(S3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC(=C(S3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O3S/c1-11(2)17-19-12(3)9-16(20-17)21-5-7-22(8-6-21)18(24)15-10-14(23(25)26)13(4)27-15/h9-11H,5-8H2,1-4H3