phenacyl 3-azanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate

Systemtic Name: phenacyl 3-azanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate Openeye Name: phenacyl 3-amino-4-isopropylsulfonyl-thiophene-2-carboxylate CAS Name: 3-amino-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid phenacyl ester IUPAC Name: phenacyl 3-amino-4-propan-2-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-amino-4-isopropylsulfonyl-thiophene-2-carboxylic acid phenacyl ester Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CSC(=C1N)C(=O)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)S(=O)(=O)C1=CSC(=C1N)C(=O)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO5S2/c1-10(2)24(20,21)13-9-23-15(14(13)17)16(19)22-8-12(18)11-6-4-3-5-7-11/h3-7,9-10H,8,17H2,1-2H3