2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-[(3-nitrophenyl)methyl]ethanamide

Systemtic Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-[(3-nitrophenyl)methyl]ethanamide Openeye Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-[(3-nitrophenyl)methyl]acetamide CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-N-methyl-N-[(3-nitrophenyl)methyl]acetamide IUPAC Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-[(3-nitrophenyl)methyl]acetamide Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]-N-methyl-N-(3-nitrobenzyl)acetamide Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H18N4O3S2/c1-11-12(2)27-18-16(11)17(19-10-20-18)26-9-15(23)21(3)8-13-5-4-6-14(7-13)22(24)25/h4-7,10H,8-9H2,1-3H3