N-[3-(dimethylamino)propyl]-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-3-nitro-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Openeye Name: N-[3-(dimethylamino)propyl]-3-nitro-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]benzamide CAS Name: N-[3-(dimethylamino)propyl]-3-nitro-N-[2-oxo-2-(2-thiazolylamino)ethyl]benzamide IUPAC Name: N-[3-(dimethylamino)propyl]-3-nitro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide Traditional Name: N-[3-(dimethylamino)propyl]-N-[2-keto-2-(thiazol-2-ylamino)ethyl]-3-nitro-benzamide Formula: C17H21N5O4S MolecularWeight: 391.44474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CC(=O)NC1=NC=CS1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(CC(=O)NC1=NC=CS1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O4S/c1-20(2)8-4-9-21(12-15(23)19-17-18-7-10-27-17)16(24)13-5-3-6-14(11-13)22(25)26/h3,5-7,10-11H,4,8-9,12H2,1-2H3,(H,18,19,23)