propan-2-yl N-[3-(2-methylpyrazol-3-yl)-4-(2-thiomorpholin-4-ylethoxy)phenyl]carbamate

Systemtic Name: propan-2-yl N-[3-(2-methylpyrazol-3-yl)-4-(2-thiomorpholin-4-ylethoxy)phenyl]carbamate Openeye Name: isopropyl N-[3-(2-methylpyrazol-3-yl)-4-(2-thiomorpholinoethoxy)phenyl]carbamate CAS Name: N-[3-(2-methyl-3-pyrazolyl)-4-(2-thiomorpholin-4-ylethoxy)phenyl]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-[3-(2-methylpyrazol-3-yl)-4-(2-thiomorpholin-4-ylethoxy)phenyl]carbamate Traditional Name: N-[3-(2-methylpyrazol-3-yl)-4-(2-thiomorpholinoethoxy)phenyl]carbamic acid isopropyl ester Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=CC(=C(C=C1)OCCN2CCSCC2)C3=CC=NN3C

Isomeric SMILES

CC(C)OC(=O)NC1=CC(=C(C=C1)OCCN2CCSCC2)C3=CC=NN3C

InChI

InChI=1S/C20H28N4O3S/c1-15(2)27-20(25)22-16-4-5-19(17(14-16)18-6-7-21-23(18)3)26-11-8-24-9-12-28-13-10-24/h4-7,14-15H,8-13H2,1-3H3,(H,22,25)