N-[(3,4-dimethoxyphenyl)methyl]-6-nitro-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-6-nitro-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-6-nitro-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-6-nitro-2-(2-pyrazinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-6-nitro-2-pyrazin-2-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-nitro-2-pyrazin-2-yl-thieno[2,3-d]pyrimidin-4-yl)-veratryl-amine Formula: C19H16N6O4S MolecularWeight: 424.43314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=C(SC3=NC(=N2)C4=NC=CN=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=C(SC3=NC(=N2)C4=NC=CN=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C19H16N6O4S/c1-28-14-4-3-11(7-15(14)29-2)9-22-17-12-8-16(25(26)27)30-19(12)24-18(23-17)13-10-20-5-6-21-13/h3-8,10H,9H2,1-2H3,(H,22,23,24)