2-methyl-5-[2-(5-methyl-3-phenyl-1-quinolin-3-yl-6-sulfanylidene-3aH-pentalen-2-yl)propan-2-yl]-4-phenyl-6-quinolin-3-yl-3aH-pentalene-1-thione

Systemtic Name: 2-methyl-5-[2-(5-methyl-3-phenyl-1-quinolin-3-yl-6-sulfanylidene-3aH-pentalen-2-yl)propan-2-yl]-4-phenyl-6-quinolin-3-yl-3aH-pentalene-1-thione Openeye Name: 2-methyl-5-[1-methyl-1-[5-methyl-3-phenyl-1-(3-quinolyl)-6-thioxo-3aH-pentalen-2-yl]ethyl]-4-phenyl-6-(3-quinolyl)-3aH-pentalene-1-thione CAS Name: 2-methyl-5-[2-[5-methyl-3-phenyl-1-(3-quinolinyl)-6-sulfanylidene-3aH-pentalen-2-yl]propan-2-yl]-4-phenyl-6-(3-quinolinyl)-3aH-pentalene-1-thione IUPAC Name: 2-methyl-5-[2-(5-methyl-3-phenyl-1-quinolin-3-yl-6-sulfanylidene-3aH-pentalen-2-yl)propan-2-yl]-4-phenyl-6-quinolin-3-yl-3aH-pentalene-1-thione Traditional Name: 2-methyl-5-[1-methyl-1-[5-methyl-3-phenyl-1-(3-quinolyl)-6-thioxo-3aH-pentalen-2-yl]ethyl]-4-phenyl-6-(3-quinolyl)-3aH-pentalene-1-thione Formula: C51H38N2S2 MolecularWeight: 742.99082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2C(=C(C(=C2C1=S)C3=CC4=CC=CC=C4N=C3)C(C)(C)C5=C(C6C=C(C(=S)C6=C5C7=CC8=CC=CC=C8N=C7)C)C9=CC=CC=C9)C1=CC=CC=C1

Isomeric SMILES

CC1=CC2C(=C(C(=C2C1=S)C3=CC4=CC=CC=C4N=C3)C(C)(C)C5=C(C6C=C(C(=S)C6=C5C7=CC8=CC=CC=C8N=C7)C)C9=CC=CC=C9)C1=CC=CC=C1

InChI

InChI=1S/C51H38N2S2/c1-29-23-37-41(31-15-7-5-8-16-31)47(43(45(37)49(29)54)35-25-33-19-11-13-21-39(33)52-27-35)51(3,4)48-42(32-17-9-6-10-18-32)38-24-30(2)50(55)46(38)44(48)36-26-34-20-12-14-22-40(34)53-28-36/h5-28,37-38H,1-4H3