5-[2-(3-bromanyl-4-methoxy-phenyl)ethylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide

Systemtic Name: 5-[2-(3-bromanyl-4-methoxy-phenyl)ethylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Openeye Name: 5-[2-(3-bromo-4-methoxy-phenyl)ethylcarbamoylamino]-3-(3-pyridylmethoxy)isothiazole-4-carboxamide CAS Name: 5-[[[2-(3-bromo-4-methoxyphenyl)ethylamino]-oxomethyl]amino]-3-(3-pyridinylmethoxy)-4-isothiazolecarboxamide IUPAC Name: 5-[2-(3-bromo-4-methoxyphenyl)ethylcarbamoylamino]-3-(pyridin-3-ylmethoxy)-1,2-thiazole-4-carboxamide Traditional Name: 5-[2-(3-bromo-4-methoxy-phenyl)ethylcarbamoylamino]-3-(3-pyridylmethoxy)isothiazole-4-carboxamide Formula: C20H20BrN5O4S MolecularWeight: 506.3729

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)NC2=C(C(=NS2)OCC3=CN=CC=C3)C(=O)N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)NC2=C(C(=NS2)OCC3=CN=CC=C3)C(=O)N)Br

InChI

InChI=1S/C20H20BrN5O4S/c1-29-15-5-4-12(9-14(15)21)6-8-24-20(28)25-19-16(17(22)27)18(26-31-19)30-11-13-3-2-7-23-10-13/h2-5,7,9-10H,6,8,11H2,1H3,(H2,22,27)(H2,24,25,28)