N-naphthalen-2-yl-2-[2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-naphthalen-2-yl-2-[2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(2-naphthyl)-2-[2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(2-naphthalenyl)-2-[[2-[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-oxoethyl]thio]acetamide IUPAC Name: N-naphthalen-2-yl-2-[2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazino]ethyl]thio]-N-(2-naphthyl)acetamide Formula: C25H23N5O4S2 MolecularWeight: 521.61122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSCC(=O)NC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)CSCC(=O)NC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H23N5O4S2/c31-23(26-19-6-5-17-3-1-2-4-18(17)13-19)15-35-16-24(32)28-9-11-29(12-10-28)25-27-21-8-7-20(30(33)34)14-22(21)36-25/h1-8,13-14H,9-12,15-16H2,(H,26,31)