6-[(4-methylpiperazin-1-yl)methyl]-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 6-[(4-methylpiperazin-1-yl)methyl]-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-[(4-methylpiperazin-1-yl)methyl]-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-[(4-methyl-1-piperazinyl)methyl]-5-(4-nitrophenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-[(4-methylpiperazin-1-yl)methyl]-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-[(4-methylpiperazino)methyl]-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C18H20N6O2S MolecularWeight: 384.4554

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C3=C(N=CN=C3S2)N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CC2=C(C3=C(N=CN=C3S2)N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O2S/c1-22-6-8-23(9-7-22)10-14-15(12-2-4-13(5-3-12)24(25)26)16-17(19)20-11-21-18(16)27-14/h2-5,11H,6-10H2,1H3,(H2,19,20,21)