3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(5-methylthiazol-2-yl)pyrazole-4-carboxamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(5-methyl-2-thiazolyl)-4-pyrazolecarboxamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(5-methylthiazol-2-yl)pyrazole-4-carboxamide Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCCO4)C

Isomeric SMILES

CC1=CN=C(S1)NC(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCCO4)C

InChI

InChI=1S/C18H18N4O3S/c1-11-9-19-18(26-11)20-17(23)13-10-22(2)21-16(13)12-4-5-14-15(8-12)25-7-3-6-24-14/h4-5,8-10H,3,6-7H2,1-2H3,(H,19,20,23)