N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-2-(methylamino)-5-nitro-benzamide

Systemtic Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-2-(methylamino)-5-nitro-benzamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-2-(methylamino)-5-nitro-benzamide CAS Name: N-[4-[5-(acetamidomethyl)-2-thiophenyl]-2-thiazolyl]-2-(methylamino)-5-nitrobenzamide IUPAC Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-2-(methylamino)-5-nitrobenzamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-2-(methylamino)-5-nitro-benzamide Formula: C18H17N5O4S2 MolecularWeight: 431.48868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])NC

InChI

InChI=1S/C18H17N5O4S2/c1-10(24)20-8-12-4-6-16(29-12)15-9-28-18(21-15)22-17(25)13-7-11(23(26)27)3-5-14(13)19-2/h3-7,9,19H,8H2,1-2H3,(H,20,24)(H,21,22,25)