N-[(5-bromanylthiophen-2-yl)methyl]-3-methyl-4-nitro-N-prop-2-enyl-benzamide

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-3-methyl-4-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[(5-bromo-2-thienyl)methyl]-3-methyl-4-nitro-benzamide CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-3-methyl-4-nitro-N-prop-2-enylbenzamide IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-3-methyl-4-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[(5-bromo-2-thienyl)methyl]-3-methyl-4-nitro-benzamide Formula: C16H15BrN2O3S MolecularWeight: 395.2709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N(CC=C)CC2=CC=C(S2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N(CC=C)CC2=CC=C(S2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H15BrN2O3S/c1-3-8-18(10-13-5-7-15(17)23-13)16(20)12-4-6-14(19(21)22)11(2)9-12/h3-7,9H,1,8,10H2,2H3