N-[3,5-bis(chloranyl)phenyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-(3,5-dichlorophenyl)-4-(1-naphthylmethyl)piperazine-1-carbothioamide CAS Name: N-(3,5-dichlorophenyl)-4-(1-naphthalenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dichlorophenyl)-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(3,5-dichlorophenyl)-4-(1-naphthylmethyl)piperazine-1-carbothioamide Formula: C22H21Cl2N3S MolecularWeight: 430.39324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=S)NC4=CC(=CC(=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=CC=CC=C32)C(=S)NC4=CC(=CC(=C4)Cl)Cl

InChI

InChI=1S/C22H21Cl2N3S/c23-18-12-19(24)14-20(13-18)25-22(28)27-10-8-26(9-11-27)15-17-6-3-5-16-4-1-2-7-21(16)17/h1-7,12-14H,8-11,15H2,(H,25,28)