1,8-bis[(2-azanyl-4-pentoxy-phenyl)sulfanyl]anthracene-9,10-dione

Systemtic Name: 1,8-bis[(2-azanyl-4-pentoxy-phenyl)sulfanyl]anthracene-9,10-dione Openeye Name: 1,8-bis[(2-amino-4-pentoxy-phenyl)sulfanyl]anthracene-9,10-dione CAS Name: 1,8-bis[(2-amino-4-pentoxyphenyl)thio]anthracene-9,10-dione IUPAC Name: 1,8-bis[(2-amino-4-pentoxyphenyl)sulfanyl]anthracene-9,10-dione Traditional Name: 1,8-bis[(2-amino-4-amoxy-phenyl)thio]-9,10-anthraquinone Formula: C36H38N2O4S2 MolecularWeight: 626.82792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC(=C(C=C1)SC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4SC5=C(C=C(C=C5)OCCCCC)N)N

Isomeric SMILES

CCCCCOC1=CC(=C(C=C1)SC2=CC=CC3=C2C(=O)C4=C(C3=O)C=CC=C4SC5=C(C=C(C=C5)OCCCCC)N)N

InChI

InChI=1S/C36H38N2O4S2/c1-3-5-7-19-41-23-15-17-29(27(37)21-23)43-31-13-9-11-25-33(31)36(40)34-26(35(25)39)12-10-14-32(34)44-30-18-16-24(22-28(30)38)42-20-8-6-4-2/h9-18,21-22H,3-8,19-20,37-38H2,1-2H3