2-chloranyl-3-(10-methylsulfanyldecylamino)naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-(10-methylsulfanyldecylamino)naphthalene-1,4-dione Openeye Name: 2-chloro-3-(10-methylsulfanyldecylamino)naphthalene-1,4-dione CAS Name: 2-chloro-3-[10-(methylthio)decylamino]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-(10-methylsulfanyldecylamino)naphthalene-1,4-dione Traditional Name: 2-chloro-3-[10-(methylthio)decylamino]-1,4-naphthoquinone Formula: C21H28ClNO2S MolecularWeight: 393.97052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCCCCCCCCNC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

Isomeric SMILES

CSCCCCCCCCCCNC1=C(C(=O)C2=CC=CC=C2C1=O)Cl

InChI

InChI=1S/C21H28ClNO2S/c1-26-15-11-7-5-3-2-4-6-10-14-23-19-18(22)20(24)16-12-8-9-13-17(16)21(19)25/h8-9,12-13,23H,2-7,10-11,14-15H2,1H3