4-(1,3-dithian-2-yl)-N-[2-[(2-nitrophenyl)amino]ethyl]benzamide

Systemtic Name: 4-(1,3-dithian-2-yl)-N-[2-[(2-nitrophenyl)amino]ethyl]benzamide Openeye Name: 4-(1,3-dithian-2-yl)-N-[2-(2-nitroanilino)ethyl]benzamide CAS Name: 4-(1,3-dithian-2-yl)-N-[2-(2-nitroanilino)ethyl]benzamide IUPAC Name: 4-(1,3-dithian-2-yl)-N-[2-(2-nitroanilino)ethyl]benzamide Traditional Name: 4-(1,3-dithian-2-yl)-N-[2-(2-nitroanilino)ethyl]benzamide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S2/c23-18(14-6-8-15(9-7-14)19-26-12-3-13-27-19)21-11-10-20-16-4-1-2-5-17(16)22(24)25/h1-2,4-9,19-20H,3,10-13H2,(H,21,23)