[4-(3-methylphenyl)piperazin-1-yl]-[5-(3-nitrophenyl)furan-2-yl]methanethione

Systemtic Name: [4-(3-methylphenyl)piperazin-1-yl]-[5-(3-nitrophenyl)furan-2-yl]methanethione Openeye Name: [4-(m-tolyl)piperazin-1-yl]-[5-(3-nitrophenyl)-2-furyl]methanethione CAS Name: [4-(3-methylphenyl)-1-piperazinyl]-[5-(3-nitrophenyl)-2-furanyl]methanethione IUPAC Name: [4-(3-methylphenyl)piperazin-1-yl]-[5-(3-nitrophenyl)furan-2-yl]methanethione Traditional Name: [4-(m-tolyl)piperazino]-[5-(3-nitrophenyl)-2-furyl]methanethione Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=S)C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=S)C3=CC=C(O3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O3S/c1-16-4-2-6-18(14-16)23-10-12-24(13-11-23)22(29)21-9-8-20(28-21)17-5-3-7-19(15-17)25(26)27/h2-9,14-15H,10-13H2,1H3