N-[(4-chlorophenyl)methyl]-1-(methylsulfanylmethyl)-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(methylsulfanylmethyl)-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-(methylsulfanylmethyl)-6-(morpholinomethyl)-4-oxo-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-[(methylthio)methyl]-6-(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(methylsulfanylmethyl)-6-(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-1-[(methylthio)methyl]-6-(morpholinomethyl)cinnoline-3-carboxamide Formula: C23H25ClN4O3S MolecularWeight: 472.9876

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Descriptors Computed from Structure

Canonical SMILES:

CSCN1C2=C(C=C(C=C2)CN3CCOCC3)C(=O)C(=N1)C(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CSCN1C2=C(C=C(C=C2)CN3CCOCC3)C(=O)C(=N1)C(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H25ClN4O3S/c1-32-15-28-20-7-4-17(14-27-8-10-31-11-9-27)12-19(20)22(29)21(26-28)23(30)25-13-16-2-5-18(24)6-3-16/h2-7,12H,8-11,13-15H2,1H3,(H,25,30)