5-[[(3S)-3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]thiophene-3-carboximidamide

Systemtic Name: 5-[[(3S)-3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]thiophene-3-carboximidamide Openeye Name: 5-[[(3S)-3-[(7-methoxy-2-naphthyl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]methyl]thiophene-3-carboxamidine CAS Name: 5-[[(3S)-3-[(7-methoxy-2-naphthalenyl)sulfonylamino]-2-oxo-1-pyrrolidinyl]methyl]-3-thiophenecarboximidamide IUPAC Name: 5-[[(3S)-3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]methyl]thiophene-3-carboximidamide Traditional Name: 5-[[(3S)-2-keto-3-[(7-methoxy-2-naphthyl)sulfonylamino]pyrrolidino]methyl]thiophene-3-carboxamidine Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)NC3CCN(C3=O)CC4=CC(=CS4)C(=N)N

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N[C@H]3CCN(C3=O)CC4=CC(=CS4)C(=N)N

InChI

InChI=1S/C21H22N4O4S2/c1-29-16-4-2-13-3-5-18(10-14(13)8-16)31(27,28)24-19-6-7-25(21(19)26)11-17-9-15(12-30-17)20(22)23/h2-5,8-10,12,19,24H,6-7,11H2,1H3,(H3,22,23)/t19-/m0/s1