1,4-bis(azanyl)-2,3-bis[(4-ethylphenyl)sulfanyl]anthracene-9,10-dione

Systemtic Name: 1,4-bis(azanyl)-2,3-bis[(4-ethylphenyl)sulfanyl]anthracene-9,10-dione Openeye Name: 1,4-diamino-2,3-bis[(4-ethylphenyl)sulfanyl]anthracene-9,10-dione CAS Name: 1,4-diamino-2,3-bis[(4-ethylphenyl)thio]anthracene-9,10-dione IUPAC Name: 1,4-diamino-2,3-bis[(4-ethylphenyl)sulfanyl]anthracene-9,10-dione Traditional Name: 1,4-diamino-2,3-bis[(4-ethylphenyl)thio]-9,10-anthraquinone Formula: C30H26N2O2S2 MolecularWeight: 510.66964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)SC2=C(C3=C(C(=C2SC4=CC=C(C=C4)CC)N)C(=O)C5=CC=CC=C5C3=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)SC2=C(C3=C(C(=C2SC4=CC=C(C=C4)CC)N)C(=O)C5=CC=CC=C5C3=O)N

InChI

InChI=1S/C30H26N2O2S2/c1-3-17-9-13-19(14-10-17)35-29-25(31)23-24(28(34)22-8-6-5-7-21(22)27(23)33)26(32)30(29)36-20-15-11-18(4-2)12-16-20/h5-16H,3-4,31-32H2,1-2H3