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

Systemtic Name: 3-[[3-[(4-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide Openeye Name: 3-[[3-[(4-methylbenzothiophen-2-yl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]methyl]benzamidine CAS Name: 3-[[3-[(4-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-oxo-1-pyrrolidinyl]methyl]benzenecarboximidamide IUPAC Name: 3-[[3-[(4-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]methyl]benzenecarboximidamide Traditional Name: 3-[[2-keto-3-[(4-methylbenzothiophen-2-yl)sulfonylamino]pyrrolidino]methyl]benzamidine Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(SC2=CC=C1)S(=O)(=O)NC3CCN(C3=O)CC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC1=C2C=C(SC2=CC=C1)S(=O)(=O)NC3CCN(C3=O)CC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C21H22N4O3S2/c1-13-4-2-7-18-16(13)11-19(29-18)30(27,28)24-17-8-9-25(21(17)26)12-14-5-3-6-15(10-14)20(22)23/h2-7,10-11,17,24H,8-9,12H2,1H3,(H3,22,23)