N'-[3-[[(2S)-2-(hydroxymethyl)pyrrolidin-2-yl]methyl]-4-methoxy-phenyl]thiophene-2-carboximidamide

Systemtic Name: N'-[3-[[(2S)-2-(hydroxymethyl)pyrrolidin-2-yl]methyl]-4-methoxy-phenyl]thiophene-2-carboximidamide Openeye Name: N'-[3-[[(2S)-2-(hydroxymethyl)pyrrolidin-2-yl]methyl]-4-methoxy-phenyl]thiophene-2-carboxamidine CAS Name: N'-[3-[[(2S)-2-(hydroxymethyl)-2-pyrrolidinyl]methyl]-4-methoxyphenyl]-2-thiophenecarboximidamide IUPAC Name: N'-[3-[[(2S)-2-(hydroxymethyl)pyrrolidin-2-yl]methyl]-4-methoxyphenyl]thiophene-2-carboximidamide Traditional Name: N'-[4-methoxy-3-[[(2S)-2-methylolpyrrolidin-2-yl]methyl]phenyl]thiophene-2-carboxamidine Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N=C(C2=CC=CS2)N)CC3(CCCN3)CO

Isomeric SMILES

COC1=C(C=C(C=C1)N=C(C2=CC=CS2)N)C[C@@]3(CCCN3)CO

InChI

InChI=1S/C18H23N3O2S/c1-23-15-6-5-14(21-17(19)16-4-2-9-24-16)10-13(15)11-18(12-22)7-3-8-20-18/h2,4-6,9-10,20,22H,3,7-8,11-12H2,1H3,(H2,19,21)/t18-/m0/s1