2-methyl-4-(5-nitroquinolin-8-yl)oxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine

Systemtic Name: 2-methyl-4-(5-nitroquinolin-8-yl)oxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 2-methyl-4-[(5-nitro-8-quinolyl)oxy]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 2-methyl-4-[(5-nitro-8-quinolinyl)oxy]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 2-methyl-4-(5-nitroquinolin-8-yl)oxy-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 2-methyl-4-[(5-nitro-8-quinolyl)oxy]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C3=C(CCCC3)SC2=N1)OC4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=N5

Isomeric SMILES

CC1=NC(=C2C3=C(CCCC3)SC2=N1)OC4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=N5

InChI

InChI=1S/C20H16N4O3S/c1-11-22-19(17-13-5-2-3-7-16(13)28-20(17)23-11)27-15-9-8-14(24(25)26)12-6-4-10-21-18(12)15/h4,6,8-10H,2-3,5,7H2,1H3