N-cyclopropyl-5-nitro-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-cyclopropyl-5-nitro-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]pyrimidin-4-amine Openeye Name: N-cyclopropyl-5-nitro-2-[4-(2-thienylmethyl)piperazin-1-yl]pyrimidin-4-amine CAS Name: N-cyclopropyl-5-nitro-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-cyclopropyl-5-nitro-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]pyrimidin-4-amine Traditional Name: cyclopropyl-[5-nitro-2-[4-(2-thenyl)piperazino]pyrimidin-4-yl]amine Formula: C16H20N6O2S MolecularWeight: 360.434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])N3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])N3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C16H20N6O2S/c23-22(24)14-10-17-16(19-15(14)18-12-3-4-12)21-7-5-20(6-8-21)11-13-2-1-9-25-13/h1-2,9-10,12H,3-8,11H2,(H,17,18,19)