N-[[3-methyl-7-[(E)-2-methylbut-2-enoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-3-sulfonamide

Systemtic Name: N-[[3-methyl-7-[(E)-2-methylbut-2-enoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-3-sulfonamide Openeye Name: N-[[3-methyl-7-[(E)-2-methylbut-2-enoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-3-sulfonamide CAS Name: N-[[3-methyl-7-[(E)-2-methyl-1-oxobut-2-enyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-3-thiophenesulfonamide IUPAC Name: N-[[3-methyl-7-[(E)-2-methylbut-2-enoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-3-sulfonamide Traditional Name: N-[[3-methyl-7-[(E)-2-methylbut-2-enoyl]-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]thiophene-3-sulfonamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C(=O)N1CCC2=C(C(=NC=C2C1)C)CNS(=O)(=O)C3=CSC=C3

Isomeric SMILES

C/C=C(\C)/C(=O)N1CCC2=C(C(=NC=C2C1)C)CNS(=O)(=O)C3=CSC=C3

InChI

InChI=1S/C19H23N3O3S2/c1-4-13(2)19(23)22-7-5-17-15(11-22)9-20-14(3)18(17)10-21-27(24,25)16-6-8-26-12-16/h4,6,8-9,12,21H,5,7,10-11H2,1-3H3/b13-4+