[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanethione

Systemtic Name: [5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-1-yl]methanethione Openeye Name: (4-benzylpiperazin-1-yl)-[5-(3-chloro-4-methyl-phenyl)-2-furyl]methanethione CAS Name: [5-(3-chloro-4-methylphenyl)-2-furanyl]-[4-(phenylmethyl)-1-piperazinyl]methanethione IUPAC Name: (4-benzylpiperazin-1-yl)-[5-(3-chloro-4-methylphenyl)furan-2-yl]methanethione Traditional Name: (4-benzylpiperazino)-[5-(3-chloro-4-methyl-phenyl)-2-furyl]methanethione Formula: C23H23ClN2OS MolecularWeight: 410.95952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H23ClN2OS/c1-17-7-8-19(15-20(17)24)21-9-10-22(27-21)23(28)26-13-11-25(12-14-26)16-18-5-3-2-4-6-18/h2-10,15H,11-14,16H2,1H3