N-(1,2-dihydroacenaphthylen-5-yl)-2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanamide

Systemtic Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanamide Openeye Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]acetamide CAS Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]acetamide IUPAC Name: N-(1,2-dihydroacenaphthylen-5-yl)-2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]acetamide Traditional Name: N-acenaphthen-5-yl-2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]acetamide Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)CN4CCN(CC4)C5=NC6=C(S5)C=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)CN4CCN(CC4)C5=NC6=C(S5)C=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C25H23N5O3S/c31-23(26-20-8-6-17-5-4-16-2-1-3-19(20)24(16)17)15-28-10-12-29(13-11-28)25-27-21-9-7-18(30(32)33)14-22(21)34-25/h1-3,6-9,14H,4-5,10-13,15H2,(H,26,31)