N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,8-dimethyl-4H-thiochromeno[4,3-c]pyrazole-3-carboxamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)NC4=CC5=C(C=C4)OCCO5)C

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=C2N(N=C3C(=O)NC4=CC5=C(C=C4)OCCO5)C

InChI

InChI=1S/C21H19N3O3S/c1-12-3-6-18-14(9-12)20-15(11-28-18)19(23-24(20)2)21(25)22-13-4-5-16-17(10-13)27-8-7-26-16/h3-6,9-10H,7-8,11H2,1-2H3,(H,22,25)