(E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-1,3-thiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-1,3-thiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methylthiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-2-thiazolyl)-2-propenamide IUPAC Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methyl-1,3-thiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-methylthiazol-2-yl)acrylamide Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C=CC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CSC(=N1)NC(=O)/C=C/C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H16N2O3S/c1-11-10-22-16(17-11)18-15(19)6-4-12-3-5-13-14(9-12)21-8-2-7-20-13/h3-6,9-10H,2,7-8H2,1H3,(H,17,18,19)/b6-4+