2-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)carbonyl]-3-[(4-nitrophenyl)amino]prop-2-enenitrile

Systemtic Name: 2-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)carbonyl]-3-[(4-nitrophenyl)amino]prop-2-enenitrile Openeye Name: 2-(5-chloro-3-methyl-benzothiophene-2-carbonyl)-3-(4-nitroanilino)prop-2-enenitrile CAS Name: 2-[(5-chloro-3-methyl-1-benzothiophen-2-yl)-oxomethyl]-3-(4-nitroanilino)-2-propenenitrile IUPAC Name: 2-(5-chloro-3-methyl-1-benzothiophene-2-carbonyl)-3-(4-nitroanilino)prop-2-enenitrile Traditional Name: 2-(5-chloro-3-methyl-benzothiophene-2-carbonyl)-3-(4-nitroanilino)acrylonitrile Formula: C19H12ClN3O3S MolecularWeight: 397.83488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)C(=CNC3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)C(=CNC3=CC=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C19H12ClN3O3S/c1-11-16-8-13(20)2-7-17(16)27-19(11)18(24)12(9-21)10-22-14-3-5-15(6-4-14)23(25)26/h2-8,10,22H,1H3