1-(2-methoxy-4-nitro-phenyl)-3-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]thiourea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]thiourea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]thiourea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-[(6-phenyl-4-thieno[3,2-d]pyrimidinyl)amino]thiourea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]thiourea Traditional Name: 1-(2-methoxy-4-nitro-phenyl)-3-[(6-phenylthieno[3,2-d]pyrimidin-4-yl)amino]thiourea Formula: C20H16N6O3S2 MolecularWeight: 452.50944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC2=NC=NC3=C2SC(=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC2=NC=NC3=C2SC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N6O3S2/c1-29-16-9-13(26(27)28)7-8-14(16)23-20(30)25-24-19-18-15(21-11-22-19)10-17(31-18)12-5-3-2-4-6-12/h2-11H,1H3,(H,21,22,24)(H2,23,25,30)