(Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile Openeye Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitro-phenyl]-2-(morpholine-4-carbonyl)prop-2-enenitrile CAS Name: (Z)-3-[4-[(4-chlorophenyl)thio]-3-nitrophenyl]-2-[4-morpholinyl(oxo)methyl]-2-propenenitrile IUPAC Name: (Z)-3-[4-(4-chlorophenyl)sulfanyl-3-nitrophenyl]-2-(morpholine-4-carbonyl)prop-2-enenitrile Traditional Name: (Z)-3-[4-[(4-chlorophenyl)thio]-3-nitro-phenyl]-2-(morpholine-4-carbonyl)acrylonitrile Formula: C20H16ClN3O4S MolecularWeight: 429.87674

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1COCCN1C(=O)/C(=C\C2=CC(=C(C=C2)SC3=CC=C(C=C3)Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C20H16ClN3O4S/c21-16-2-4-17(5-3-16)29-19-6-1-14(12-18(19)24(26)27)11-15(13-22)20(25)23-7-9-28-10-8-23/h1-6,11-12H,7-10H2/b15-11-