4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-nitro-benzamide

Systemtic Name: 4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-nitro-benzamide Openeye Name: 4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-nitro-benzamide CAS Name: 4-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-3-nitrobenzamide IUPAC Name: 4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-nitrobenzamide Traditional Name: 4-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]-3-nitro-benzamide Formula: C15H12N4O3S2 MolecularWeight: 360.41078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])C

InChI

InChI=1S/C15H12N4O3S2/c1-7-8(2)23-14-12(7)15(18-6-17-14)24-11-4-3-9(13(16)20)5-10(11)19(21)22/h3-6H,1-2H3,(H2,16,20)