N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-(2-methylimidazol-1-yl)-6-nitro-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-(2-methylimidazol-1-yl)-6-nitro-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-2-(2-methylimidazol-1-yl)-6-nitro-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-(2-methyl-1-imidazolyl)-6-nitro-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-(2-methylimidazol-1-yl)-6-nitrothieno[2,3-d]pyrimidin-4-amine Traditional Name: (3-chloro-4-methoxy-benzyl)-[2-(2-methylimidazol-1-yl)-6-nitro-thieno[2,3-d]pyrimidin-4-yl]amine Formula: C18H15ClN6O3S MolecularWeight: 430.8681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=NC(=C3C=C(SC3=N2)[N+](=O)[O-])NCC4=CC(=C(C=C4)OC)Cl

Isomeric SMILES

CC1=NC=CN1C2=NC(=C3C=C(SC3=N2)[N+](=O)[O-])NCC4=CC(=C(C=C4)OC)Cl

InChI

InChI=1S/C18H15ClN6O3S/c1-10-20-5-6-24(10)18-22-16(12-8-15(25(26)27)29-17(12)23-18)21-9-11-3-4-14(28-2)13(19)7-11/h3-8H,9H2,1-2H3,(H,21,22,23)