1-[(6-azanylpyridin-3-yl)methyl]-3-[(4-morpholin-4-ylphenyl)amino]-4-phenyl-pyrrole-2,5-dithione

Systemtic Name: 1-[(6-azanylpyridin-3-yl)methyl]-3-[(4-morpholin-4-ylphenyl)amino]-4-phenyl-pyrrole-2,5-dithione Openeye Name: 1-[(6-amino-3-pyridyl)methyl]-3-(4-morpholinoanilino)-4-phenyl-pyrrole-2,5-dithione CAS Name: 1-[(6-amino-3-pyridinyl)methyl]-3-[4-(4-morpholinyl)anilino]-4-phenylpyrrole-2,5-dithione IUPAC Name: 1-[(6-aminopyridin-3-yl)methyl]-3-(4-morpholin-4-ylanilino)-4-phenylpyrrole-2,5-dithione Traditional Name: 1-[(6-amino-3-pyridyl)methyl]-3-(4-morpholinoanilino)-4-phenyl-3-pyrroline-2,5-dithione Formula: C26H25N5OS2 MolecularWeight: 487.6396

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=C(C(=S)N(C3=S)CC4=CN=C(C=C4)N)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=C(C(=S)N(C3=S)CC4=CN=C(C=C4)N)C5=CC=CC=C5

InChI

InChI=1S/C26H25N5OS2/c27-22-11-6-18(16-28-22)17-31-25(33)23(19-4-2-1-3-5-19)24(26(31)34)29-20-7-9-21(10-8-20)30-12-14-32-15-13-30/h1-11,16,29H,12-15,17H2,(H2,27,28)