5-chloranyl-N-[[3-chloranyl-4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-chloranyl-N-[[3-chloranyl-4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-chloro-N-[[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-chloro-N-[[3-chloro-4-(4-ethyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-chloro-N-[[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-chloro-N-[[3-chloro-4-(4-ethylpiperazino)phenyl]thiocarbamoyl]-1-naphthamide Formula: C24H24Cl2N4OS MolecularWeight: 487.44456

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Cl)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Cl)Cl

InChI

InChI=1S/C24H24Cl2N4OS/c1-2-29-11-13-30(14-12-29)22-10-9-16(15-21(22)26)27-24(32)28-23(31)19-7-3-6-18-17(19)5-4-8-20(18)25/h3-10,15H,2,11-14H2,1H3,(H2,27,28,31,32)