N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-N-prop-2-enyl-benzamide

Systemtic Name: N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[2-[(5-methylthiazol-2-yl)amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[(5-methyl-2-thiazolyl)amino]-2-oxoethyl]-3-nitro-N-prop-2-enylbenzamide IUPAC Name: N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[2-keto-2-[(5-methylthiazol-2-yl)amino]ethyl]-3-nitro-benzamide Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC(=O)CN(CC=C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(S1)NC(=O)CN(CC=C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S/c1-3-7-19(10-14(21)18-16-17-9-11(2)25-16)15(22)12-5-4-6-13(8-12)20(23)24/h3-6,8-9H,1,7,10H2,2H3,(H,17,18,21)