1-(methylamino)-2-propan-2-yl-3-sulfanyl-anthracene-9,10-dione

Systemtic Name: 1-(methylamino)-2-propan-2-yl-3-sulfanyl-anthracene-9,10-dione Openeye Name: 2-isopropyl-1-(methylamino)-3-sulfanyl-anthracene-9,10-dione CAS Name: 3-mercapto-1-(methylamino)-2-propan-2-ylanthracene-9,10-dione IUPAC Name: 1-(methylamino)-2-propan-2-yl-3-sulfanylanthracene-9,10-dione Traditional Name: 2-isopropyl-3-mercapto-1-(methylamino)-9,10-anthraquinone Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C2C(=C1NC)C(=O)C3=CC=CC=C3C2=O)S

Isomeric SMILES

CC(C)C1=C(C=C2C(=C1NC)C(=O)C3=CC=CC=C3C2=O)S

InChI

InChI=1S/C18H17NO2S/c1-9(2)14-13(22)8-12-15(16(14)19-3)18(21)11-7-5-4-6-10(11)17(12)20/h4-9,19,22H,1-3H3