3-[[(3S)-3-[(4-chloranylthiophen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide

Systemtic Name: 3-[[(3S)-3-[(4-chloranylthiophen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide Openeye Name: 3-[[(3S)-3-[(4-chloro-2-thienyl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]methyl]benzamidine CAS Name: 3-[[(3S)-3-[(4-chloro-2-thiophenyl)sulfonylamino]-2-oxo-1-pyrrolidinyl]methyl]benzenecarboximidamide IUPAC Name: 3-[[(3S)-3-[(4-chlorothiophen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]methyl]benzenecarboximidamide Traditional Name: 3-[[(3S)-3-[(4-chloro-2-thienyl)sulfonylamino]-2-keto-pyrrolidino]methyl]benzamidine Formula: C16H17ClN4O3S2 MolecularWeight: 412.91418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NS(=O)(=O)C2=CC(=CS2)Cl)CC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1CN(C(=O)[C@H]1NS(=O)(=O)C2=CC(=CS2)Cl)CC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C16H17ClN4O3S2/c17-12-7-14(25-9-12)26(23,24)20-13-4-5-21(16(13)22)8-10-2-1-3-11(6-10)15(18)19/h1-3,6-7,9,13,20H,4-5,8H2,(H3,18,19)/t13-/m0/s1