N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-3-(4-chloranyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-3-(4-chloranyl-3-nitro-phenyl)prop-2-enamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-3-(4-chloro-3-nitro-phenyl)prop-2-enamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-3-(4-chloro-3-nitrophenyl)-2-propenamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-3-(4-chloro-3-nitro-phenyl)acrylamide Formula: C22H13BrClN3O3S MolecularWeight: 514.77892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)Br)NC(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)Br)NC(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H13BrClN3O3S/c23-14-7-9-17(15(12-14)22-26-18-3-1-2-4-20(18)31-22)25-21(28)10-6-13-5-8-16(24)19(11-13)27(29)30/h1-12H,(H,25,28)