(E)-3-(3-butoxy-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Systemtic Name: (E)-3-(3-butoxy-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: (E)-3-(3-butoxy-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)thiazol-2-yl]prop-2-enenitrile CAS Name: (E)-3-(3-butoxy-4-methoxyphenyl)-2-[4-(3-nitrophenyl)-2-thiazolyl]-2-propenenitrile IUPAC Name: (E)-3-(3-butoxy-4-methoxyphenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: (E)-3-(3-butoxy-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)thiazol-2-yl]acrylonitrile Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C23H21N3O4S/c1-3-4-10-30-22-12-16(8-9-21(22)29-2)11-18(14-24)23-25-20(15-31-23)17-6-5-7-19(13-17)26(27)28/h5-9,11-13,15H,3-4,10H2,1-2H3/b18-11+