N-cyclopropyl-4-[(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)amino]-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-4-[(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)amino]-3-nitro-benzamide Openeye Name: N-cyclopropyl-4-[[2-morpholino-2-(2-thienyl)ethyl]amino]-3-nitro-benzamide CAS Name: N-cyclopropyl-4-[[2-(4-morpholinyl)-2-thiophen-2-ylethyl]amino]-3-nitrobenzamide IUPAC Name: N-cyclopropyl-4-[(2-morpholin-4-yl-2-thiophen-2-ylethyl)amino]-3-nitrobenzamide Traditional Name: N-cyclopropyl-4-[[2-morpholino-2-(2-thienyl)ethyl]amino]-3-nitro-benzamide Formula: C20H24N4O4S MolecularWeight: 416.49396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)NCC(C3=CC=CS3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)NCC(C3=CC=CS3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4S/c25-20(22-15-4-5-15)14-3-6-16(17(12-14)24(26)27)21-13-18(19-2-1-11-29-19)23-7-9-28-10-8-23/h1-3,6,11-12,15,18,21H,4-5,7-10,13H2,(H,22,25)