4-[4-(6-chloranyl-3-methyl-quinoxalin-2-yl)oxyphenoxy]-2-propyl-3-sulfanylidene-pentanenitrile

Systemtic Name: 4-[4-(6-chloranyl-3-methyl-quinoxalin-2-yl)oxyphenoxy]-2-propyl-3-sulfanylidene-pentanenitrile Openeye Name: 4-[4-(6-chloro-3-methyl-quinoxalin-2-yl)oxyphenoxy]-2-propyl-3-thioxo-pentanenitrile CAS Name: 4-[4-[(6-chloro-3-methyl-2-quinoxalinyl)oxy]phenoxy]-2-propyl-3-sulfanylidenepentanenitrile IUPAC Name: 4-[4-(6-chloro-3-methylquinoxalin-2-yl)oxyphenoxy]-2-propyl-3-sulfanylidenepentanenitrile Traditional Name: 4-[4-(6-chloro-3-methyl-quinoxalin-2-yl)oxyphenoxy]-2-propyl-3-thioxo-valeronitrile Formula: C23H22ClN3O2S MolecularWeight: 439.95768

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#N)C(=S)C(C)OC1=CC=C(C=C1)OC2=NC3=C(C=C(C=C3)Cl)N=C2C

Isomeric SMILES

CCCC(C#N)C(=S)C(C)OC1=CC=C(C=C1)OC2=NC3=C(C=C(C=C3)Cl)N=C2C

InChI

InChI=1S/C23H22ClN3O2S/c1-4-5-16(13-25)22(30)15(3)28-18-7-9-19(10-8-18)29-23-14(2)26-21-12-17(24)6-11-20(21)27-23/h6-12,15-16H,4-5H2,1-3H3