3-chloranyl-6-methyl-N-[4-(N'-propan-2-ylcarbamimidoyl)phenyl]-1-benzothiophene-2-carboxamide hydrochloride

Systemtic Name: 3-chloranyl-6-methyl-N-[4-(N'-propan-2-ylcarbamimidoyl)phenyl]-1-benzothiophene-2-carboxamide hydrochloride Openeye Name: 3-chloro-N-[4-(N'-isopropylcarbamimidoyl)phenyl]-6-methyl-benzothiophene-2-carboxamide hydrochloride CAS Name: N-[4-[amino(propan-2-ylimino)methyl]phenyl]-3-chloro-6-methyl-1-benzothiophene-2-carboxamide hydrochloride IUPAC Name: 3-chloro-6-methyl-N-[4-(N'-propan-2-ylcarbamimidoyl)phenyl]-1-benzothiophene-2-carboxamide hydrochloride Traditional Name: 3-chloro-N-[4-(N'-isopropylamidino)phenyl]-6-methyl-benzothiophene-2-carboxamide hydrochloride Formula: C20H21Cl2N3OS MolecularWeight: 422.37124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)C(=NC(C)C)N)Cl.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)C(=NC(C)C)N)Cl.Cl

InChI

InChI=1S/C20H20ClN3OS.ClH/c1-11(2)23-19(22)13-5-7-14(8-6-13)24-20(25)18-17(21)15-9-4-12(3)10-16(15)26-18;/h4-11H,1-3H3,(H2,22,23)(H,24,25);1H