1-azanyl-4-(cyclohexylamino)-2-oxidanylsulfanyl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-(cyclohexylamino)-2-oxidanylsulfanyl-anthracene-9,10-dione Openeye Name: 1-amino-4-(cyclohexylamino)-2-hydroxysulfanyl-anthracene-9,10-dione CAS Name: 1-amino-4-(cyclohexylamino)-9,10-dioxo-2-anthracenesulfenic acid IUPAC Name: 1-amino-4-(cyclohexylamino)-2-hydroxysulfanylanthracene-9,10-dione Traditional Name: 1-amino-4-(cyclohexylamino)-2-sulfeno-9,10-anthraquinone Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)SO

Isomeric SMILES

C1CCC(CC1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)SO

InChI

InChI=1S/C20H20N2O3S/c21-18-15(26-25)10-14(22-11-6-2-1-3-7-11)16-17(18)20(24)13-9-5-4-8-12(13)19(16)23/h4-5,8-11,22,25H,1-3,6-7,21H2