3-(4-chloranyl-3-nitro-phenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Openeye Name: 3-(4-chloro-3-nitro-phenyl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)prop-2-enamide CAS Name: 3-(4-chloro-3-nitrophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-propenamide IUPAC Name: 3-(4-chloro-3-nitrophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Traditional Name: 3-(4-chloro-3-nitro-phenyl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acrylamide Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C=CC3=CC(=C(C=C3)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H14ClN3O3S/c19-14-7-5-11(9-15(14)22(24)25)6-8-17(23)21-18-13(10-20)12-3-1-2-4-16(12)26-18/h5-9H,1-4H2,(H,21,23)