2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)-N-(2-thienylmethyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-nitrophenyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(4-nitrophenyl)-N-(2-thenyl)acetamide Formula: C20H15N3O3S3 MolecularWeight: 441.5464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)N(CC3=CC=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)N(CC3=CC=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O3S3/c24-19(13-28-20-21-17-5-1-2-6-18(17)29-20)22(12-16-4-3-11-27-16)14-7-9-15(10-8-14)23(25)26/h1-11H,12-13H2