1-butyl-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-1-methylsulfonyl-urea

Systemtic Name: 1-butyl-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-1-methylsulfonyl-urea Openeye Name: 1-butyl-3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]-1-methylsulfonyl-urea CAS Name: 1-butyl-3-[[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-oxomethyl]-1-methylsulfonylurea IUPAC Name: 1-butyl-3-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-1-methylsulfonylurea Traditional Name: 1-butyl-3-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]-1-mesyl-urea Formula: C16H22N4O4S2 MolecularWeight: 398.50028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)NC(=O)NC1=C(C2=C(S1)CCCC2)C#N)S(=O)(=O)C

Isomeric SMILES

CCCCN(C(=O)NC(=O)NC1=C(C2=C(S1)CCCC2)C#N)S(=O)(=O)C

InChI

InChI=1S/C16H22N4O4S2/c1-3-4-9-20(26(2,23)24)16(22)19-15(21)18-14-12(10-17)11-7-5-6-8-13(11)25-14/h3-9H2,1-2H3,(H2,18,19,21,22)