N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-thiophen-2-yl-prop-2-enamide hydrochloride

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-thiophen-2-yl-prop-2-enamide hydrochloride Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-(2-thienyl)prop-2-enamide hydrochloride CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-[3-(1-imidazolyl)propyl]-3-thiophen-2-yl-2-propenamide hydrochloride IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-thiophen-2-ylprop-2-enamide hydrochloride Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(3-imidazol-1-ylpropyl)-3-(2-thienyl)acrylamide hydrochloride Formula: C22H23ClN4O2S2 MolecularWeight: 475.02662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CCCN3C=CN=C3)C(=O)C=CC4=CC=CS4.Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CCCN3C=CN=C3)C(=O)C=CC4=CC=CS4.Cl

InChI

InChI=1S/C22H22N4O2S2.ClH/c1-2-28-17-6-8-19-20(15-17)30-22(24-19)26(12-4-11-25-13-10-23-16-25)21(27)9-7-18-5-3-14-29-18;/h3,5-10,13-16H,2,4,11-12H2,1H3;1H