ethyl (E)-2-[4-(N'-propan-2-ylcarbamimidoyl)phenyl]-3-thiophen-2-yl-prop-2-enoate hydrochloride

Systemtic Name: ethyl (E)-2-[4-(N'-propan-2-ylcarbamimidoyl)phenyl]-3-thiophen-2-yl-prop-2-enoate hydrochloride Openeye Name: ethyl (E)-2-[4-(N'-isopropylcarbamimidoyl)phenyl]-3-(2-thienyl)prop-2-enoate hydrochloride CAS Name: (E)-2-[4-[amino(propan-2-ylimino)methyl]phenyl]-3-thiophen-2-yl-2-propenoic acid ethyl ester hydrochloride IUPAC Name: ethyl (E)-2-[4-(N'-propan-2-ylcarbamimidoyl)phenyl]-3-thiophen-2-ylprop-2-enoate hydrochloride Traditional Name: (E)-2-[4-(N'-isopropylamidino)phenyl]-3-(2-thienyl)acrylic acid ethyl ester hydrochloride Formula: C19H23ClN2O2S MolecularWeight: 378.91612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=CS1)C2=CC=C(C=C2)C(=NC(C)C)N.Cl

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC=CS1)/C2=CC=C(C=C2)C(=NC(C)C)N.Cl

InChI

InChI=1S/C19H22N2O2S.ClH/c1-4-23-19(22)17(12-16-6-5-11-24-16)14-7-9-15(10-8-14)18(20)21-13(2)3;/h5-13H,4H2,1-3H3,(H2,20,21);1H/b17-12+;