2-(4-chlorophenyl)sulfanyl-3-(methylamino)naphthalene-1,4-dione

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-3-(methylamino)naphthalene-1,4-dione Openeye Name: 2-(4-chlorophenyl)sulfanyl-3-(methylamino)naphthalene-1,4-dione CAS Name: 2-[(4-chlorophenyl)thio]-3-(methylamino)naphthalene-1,4-dione IUPAC Name: 2-(4-chlorophenyl)sulfanyl-3-(methylamino)naphthalene-1,4-dione Traditional Name: 2-[(4-chlorophenyl)thio]-3-(methylamino)-1,4-naphthoquinone Formula: C17H12ClNO2S MolecularWeight: 329.80068

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=O)C2=CC=CC=C2C1=O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CNC1=C(C(=O)C2=CC=CC=C2C1=O)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H12ClNO2S/c1-19-14-15(20)12-4-2-3-5-13(12)16(21)17(14)22-11-8-6-10(18)7-9-11/h2-9,19H,1H3