3-chloranyl-N-(4-methoxyphenyl)-6-(N'-propan-2-ylcarbamimidoyl)-1-benzothiophene-2-carboxamide hydrochloride

Systemtic Name: 3-chloranyl-N-(4-methoxyphenyl)-6-(N'-propan-2-ylcarbamimidoyl)-1-benzothiophene-2-carboxamide hydrochloride Openeye Name: 3-chloro-6-(N'-isopropylcarbamimidoyl)-N-(4-methoxyphenyl)benzothiophene-2-carboxamide hydrochloride CAS Name: 6-[amino(propan-2-ylimino)methyl]-3-chloro-N-(4-methoxyphenyl)-1-benzothiophene-2-carboxamide hydrochloride IUPAC Name: 3-chloro-N-(4-methoxyphenyl)-6-(N'-propan-2-ylcarbamimidoyl)-1-benzothiophene-2-carboxamide hydrochloride Traditional Name: 3-chloro-6-(N'-isopropylamidino)-N-(4-methoxyphenyl)benzothiophene-2-carboxamide hydrochloride Formula: C20H21Cl2N3O2S MolecularWeight: 438.37064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(C1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)OC)Cl)N.Cl

Isomeric SMILES

CC(C)N=C(C1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)OC)Cl)N.Cl

InChI

InChI=1S/C20H20ClN3O2S.ClH/c1-11(2)23-19(22)12-4-9-15-16(10-12)27-18(17(15)21)20(25)24-13-5-7-14(26-3)8-6-13;/h4-11H,1-3H3,(H2,22,23)(H,24,25);1H