N-[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]-2-nitro-benzamide

Systemtic Name: N-[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]-2-nitro-benzamide Openeye Name: N-[4-(4-methoxyphenyl)-5-propyl-thiazol-2-yl]-2-nitro-benzamide CAS Name: N-[4-(4-methoxyphenyl)-5-propyl-2-thiazolyl]-2-nitrobenzamide IUPAC Name: N-[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]-2-nitrobenzamide Traditional Name: N-[4-(4-methoxyphenyl)-5-propyl-thiazol-2-yl]-2-nitro-benzamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)NC(=O)C2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1=C(N=C(S1)NC(=O)C2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19N3O4S/c1-3-6-17-18(13-9-11-14(27-2)12-10-13)21-20(28-17)22-19(24)15-7-4-5-8-16(15)23(25)26/h4-5,7-12H,3,6H2,1-2H3,(H,21,22,24)