(E)-2-[4-(2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(2-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(2-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-[4-(2H-chromen-3-yl)thiazol-2-yl]-3-(2-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-[4-(2H-1-benzopyran-3-yl)-2-thiazolyl]-3-(2-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(2-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-[4-(2H-chromen-3-yl)thiazol-2-yl]-3-(2-nitrophenyl)acrylonitrile Formula: C21H13N3O3S MolecularWeight: 387.41122

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=CC=C2O1)C3=CSC(=N3)C(=CC4=CC=CC=C4[N+](=O)[O-])C#N

Isomeric SMILES

C1C(=CC2=CC=CC=C2O1)C3=CSC(=N3)/C(=C/C4=CC=CC=C4[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H13N3O3S/c22-11-16(9-14-5-1-3-7-19(14)24(25)26)21-23-18(13-28-21)17-10-15-6-2-4-8-20(15)27-12-17/h1-10,13H,12H2/b16-9+