N-(1,3-benzothiazol-2-yl)-4-nitro-N-phenethyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-nitro-N-phenethyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-nitro-N-phenethyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-nitro-N-phenethylbenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-nitro-N-phenethylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-nitro-N-phenethyl-benzamide Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O3S/c26-21(17-10-12-18(13-11-17)25(27)28)24(15-14-16-6-2-1-3-7-16)22-23-19-8-4-5-9-20(19)29-22/h1-13H,14-15H2