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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(4-chloranyl-3-nitro-phenyl)prop-2-enamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(4-chloro-3-nitro-phenyl)prop-2-enamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(4-chloro-3-nitrophenyl)-2-propenamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-3-(4-chloro-3-nitro-phenyl)acrylamide Formula: C22H14ClN3O3S MolecularWeight: 435.88286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H14ClN3O3S/c23-17-11-5-14(13-19(17)26(28)29)6-12-21(27)24-16-9-7-15(8-10-16)22-25-18-3-1-2-4-20(18)30-22/h1-13H,(H,24,27)