N-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]carbothioylnaphthalene-1-carboxamide

Systemtic Name: N-[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]carbothioylnaphthalene-1-carboxamide Openeye Name: N-[4-[4-nitro-3-(1-piperidyl)phenyl]piperazine-1-carbothioyl]naphthalene-1-carboxamide CAS Name: N-[[4-[4-nitro-3-(1-piperidinyl)phenyl]-1-piperazinyl]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: N-[4-(4-nitro-3-piperidin-1-ylphenyl)piperazine-1-carbothioyl]naphthalene-1-carboxamide Traditional Name: N-[4-(4-nitro-3-piperidino-phenyl)piperazine-1-carbothioyl]-1-naphthamide Formula: C27H29N5O3S MolecularWeight: 503.61586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=S)NC(=O)C4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=S)NC(=O)C4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C27H29N5O3S/c33-26(23-10-6-8-20-7-2-3-9-22(20)23)28-27(36)31-17-15-29(16-18-31)21-11-12-24(32(34)35)25(19-21)30-13-4-1-5-14-30/h2-3,6-12,19H,1,4-5,13-18H2,(H,28,33,36)