ethyl N-[3-[4-(imidazol-1-ylmethyl)phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate

Systemtic Name: ethyl N-[3-[4-(imidazol-1-ylmethyl)phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate Openeye Name: ethyl N-[[3-[4-(imidazol-1-ylmethyl)phenyl]-5-isobutyl-2-thienyl]sulfonyl]carbamate CAS Name: N-[[3-[4-(1-imidazolylmethyl)phenyl]-5-(2-methylpropyl)-2-thiophenyl]sulfonyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-[4-(imidazol-1-ylmethyl)phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate Traditional Name: N-[[3-[4-(imidazol-1-ylmethyl)phenyl]-5-isobutyl-2-thienyl]sulfonyl]carbamic acid ethyl ester Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NS(=O)(=O)C1=C(C=C(S1)CC(C)C)C2=CC=C(C=C2)CN3C=CN=C3

Isomeric SMILES

CCOC(=O)NS(=O)(=O)C1=C(C=C(S1)CC(C)C)C2=CC=C(C=C2)CN3C=CN=C3

InChI

InChI=1S/C21H25N3O4S2/c1-4-28-21(25)23-30(26,27)20-19(12-18(29-20)11-15(2)3)17-7-5-16(6-8-17)13-24-10-9-22-14-24/h5-10,12,14-15H,4,11,13H2,1-3H3,(H,23,25)