N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfanyl-3-nitro-N-prop-2-enyl-benzamide

Systemtic Name: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfanyl-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[4-(4-chlorophenyl)thiazol-2-yl]-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide CAS Name: N-[4-(4-chlorophenyl)-2-thiazolyl]-4-[(4-fluorophenyl)thio]-3-nitro-N-prop-2-enylbenzamide IUPAC Name: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfanyl-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-N-[4-(4-chlorophenyl)thiazol-2-yl]-4-[(4-fluorophenyl)thio]-3-nitro-benzamide Formula: C25H17ClFN3O3S2 MolecularWeight: 526.002183

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)Cl)C(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C=CCN(C1=NC(=CS1)C2=CC=C(C=C2)Cl)C(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C25H17ClFN3O3S2/c1-2-13-29(25-28-21(15-34-25)16-3-6-18(26)7-4-16)24(31)17-5-12-23(22(14-17)30(32)33)35-20-10-8-19(27)9-11-20/h2-12,14-15H,1,13H2