N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclobutanecarboxamide

Systemtic Name: N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclobutanecarboxamide Openeye Name: N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclobutanecarboxamide CAS Name: N-[[4-(1-pyrrolidinylsulfonyl)anilino]-sulfanylidenemethyl]cyclobutanecarboxamide IUPAC Name: N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]cyclobutanecarboxamide Traditional Name: N-[(4-pyrrolidinosulfonylphenyl)thiocarbamoyl]cyclobutanecarboxamide Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3CCC3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3CCC3

InChI

InChI=1S/C16H21N3O3S2/c20-15(12-4-3-5-12)18-16(23)17-13-6-8-14(9-7-13)24(21,22)19-10-1-2-11-19/h6-9,12H,1-5,10-11H2,(H2,17,18,20,23)